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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
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Single/Multi-component
Isotopically Labeled
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Found 78 results

Search term: C16H16N4O8S (Found by molecular formula)
1234
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4586393

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9-/t10-,14-/m1/s1
C16H16N4O8S424.3852789500
4514699

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9+/t10-,14-/m1/s1
C16H16N4O8S424.38524761323529
7875349

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9+
C16H16N4O8S424.385220204700
5036834

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9-/t10-,14+/m1/s1
C16H16N4O8S424.3852181100
4510116

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9-
C16H16N4O8S424.3852141000
17519050
InChI=1/C16H16N4O8S/c1-28-15-7-6-13(20(24)25)9-14(15)17-16(21)10-18(29(2,26)27)11-4-3-5-12(8-11)19(22)23/h3-9H,10H2,1-2H3,(H,17,21)
C16H16N4O8S424.3852131200
37756

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/t10-,14-/m1/s1
C16H16N4O8S424.385211900
2559

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)
C16H16N4O8S424.38529700
22236631

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H16N4O8S/c1-26-19-10(7-3-2-4-27-7)13(22)18-11-14(23)20-12(16(24)25)8(6-29-15(11)20)28-5-9(17)21/h2-4,11,15H,5-6H2,1H3,(H2,17,21)(H,18,22)(H,24,25)/b19-10+
C16H16N4O8S424.385272323529
57436195

Double-bond stereo

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,6,10-11,14H,5H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9+
C16H16N4O8S424.38526600
57643435

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9+/t10-,14+/m1/s1
C16H16N4O8S424.38523300
23163557

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H16N4O8S/c1-11(16(21)17-22)18(10-12-6-2-3-7-13(12)19(23)24)29(27,28)15-9-5-4-8-14(15)20(25)26/h2-9,11,22H,10H2,1H3,(H,17,21)
C16H16N4O8S424.38523300
23163558

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H16N4O8S/c1-11(16(21)17-22)18(10-12-5-2-3-8-15(12)20(25)26)29(27,28)14-7-4-6-13(9-14)19(23)24/h2-9,11,22H,10H2,1H3,(H,17,21)
C16H16N4O8S424.38523300
23163574

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H16N4O8S/c1-11(16(21)17-22)18(10-12-4-2-3-5-15(12)20(25)26)29(27,28)14-8-6-13(7-9-14)19(23)24/h2-9,11,22H,10H2,1H3,(H,17,21)
C16H16N4O8S424.38523300
23220379

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H16N4O8S/c1-11(16(21)17-22)18(10-12-6-8-13(9-7-12)19(23)24)29(27,28)15-5-3-2-4-14(15)20(25)26/h2-9,11,22H,10H2,1H3,(H,17,21)
C16H16N4O8S424.38523300
23220390

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H16N4O8S/c1-11(16(21)17-22)18(10-12-5-7-13(8-6-12)19(23)24)29(27,28)15-4-2-3-14(9-15)20(25)26/h2-9,11,22H,10H2,1H3,(H,17,21)
C16H16N4O8S424.38523300
23220391

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H16N4O8S/c1-11(16(21)17-22)18(10-12-2-4-13(5-3-12)19(23)24)29(27,28)15-8-6-14(7-9-15)20(25)26/h2-9,11,22H,10H2,1H3,(H,17,21)
C16H16N4O8S424.38523300
24830475

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/t10-,14+/m1/s1
C16H16N4O8S424.38523300
32115133

Double-bond stereo
InChI=1/C16H16N4O8S/c1-3-28-16-14(20(23)24)7-11(8-15(16)27-2)10-17-18-29(25,26)13-6-4-5-12(9-13)19(21)22/h4-10,18H,3H2,1-2H3/b17-10+
C16H16N4O8S424.38523300
32115142

Double-bond stereo
InChI=1/C16H16N4O8S/c1-3-28-15-8-11(7-14(20(23)24)16(15)27-2)10-17-18-29(25,26)13-6-4-5-12(9-13)19(21)22/h4-10,18H,3H2,1-2H3/b17-10+
C16H16N4O8S424.38523300
1234

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