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Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
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Found 23 results

Search term: C19H17N5O7S3 (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4886668

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11-/t12-,16-/m1/s1
C19H17N5O7S3523.5626636710
4865990

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11-
C19H17N5O7S3523.5626181400
17340062

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11-/t12-,16?/m1/s1
C19H17N5O7S3523.5626137000
10725323

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11+
C19H17N5O7S3523.5626924200
4588595

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11+/t12-,16-/m1/s1
C19H17N5O7S3523.56268900
4249770

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)
C19H17N5O7S3523.5625799999997600
24828509

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/t12-,16-/m1/s1
C19H17N5O7S3523.56266600
26361205

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11+/t12-,16?/m1/s1
C19H17N5O7S3523.56264200
28507888
InChI=1/C19H17N5O7S3/c25-32(26,16-11-20-23-19(16)34(29,30)15-9-5-2-6-10-15)12-17-21-22-18(31-17)13-33(27,28)24-14-7-3-1-4-8-14/h1-11,24H,12-13H2,(H,20,23)
C19H17N5O7S3523.56262200
9974860

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H17N5O7S3/c1-30-18(29)10-4-3-9(34-10)7-5-32-16-12(15(26)24(16)13(7)17(27)28)22-14(25)11(23-31-2)8-6-33-19(20)21-8/h3-4,6,12,16H,5H2,1-2H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11-/t12-,16-/m1/s1
C19H17N5O7S3523.56262100
66454009
InChI=1/C19H17N5O7S3/c1-10-11(2)22-31-17(10)23-33(26,27)13-5-3-12(4-6-13)20-18(32)24-34(28,29)14-7-8-15-16(9-14)30-19(25)21-15/h3-9,23H,1-2H3,(H,21,25)(H2,20,24,32)
C19H17N5O7S3523.56262100
77498720

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11-/t12-,16+/m1/s1
C19H17N5O7S3523.56262100
80997591
InChI=1/C19H17N5O7S3/c1-31-17(26)12-32-19-22-21-18(33-19)20-16(25)11-23(13-7-9-14(10-8-13)24(27)28)34(29,30)15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H,20,21,25)
C19H17N5O7S3523.56261100
95724725

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,16,26H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11+
C19H17N5O7S3523.56261100
95793571

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,15-16,26H,5-6H2,1H3,(H2,20,21)(H,27,28)/b22-12+,23-11+
C19H17N5O7S3523.56261100
107446025

Double-bond stereo

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-5,7,12-13,16H,6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11-/t12-,13?,16-/m1/s1
C19H17N5O7S3523.56261500
129163681

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/t12-,16+/m1/s1
C19H17N5O7S3523.56261100
29789034

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11+/t12-,16?/m0/s1
C19H17N5O7S3523.56261100
12

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