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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 26 results

Search term: C22H20N4O9 (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
1796778
InChI=1/C22H20N4O9/c27-17(23-8-10-24(11-9-23)21(30)16-5-2-12-34-16)13-35-18(28)6-7-25-20(29)14-3-1-4-15(26(32)33)19(14)22(25)31/h1-5,12H,6-11,13H2
C22H20N4O9484.415613800
240470

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20N4O9/c27-18(23-11-20(29)35-16-8-6-15(7-9-16)26(32)33)12-25-19(28)10-17(21(25)30)24-22(31)34-13-14-4-2-1-3-5-14/h1-9,17H,10-13H2,(H,23,27)(H,24,31)
C22H20N4O9484.41566500
534702
InChI=1/C22H20N4O9/c1-34-21(28)18-16-6-3-4-7-17(16)24(19(18)22(29)35-2)9-5-8-23-20(27)13-10-14(25(30)31)12-15(11-13)26(32)33/h3-4,6-7,10-12H,5,8-9H2,1-2H3,(H,23,27)
C22H20N4O9484.41565600
12125932

Double-bond stereo
InChI=1/C22H20N4O9/c1-13-17(25(29)30)10-15(11-18(13)26(31)32)22(28)35-19-5-4-14(9-20(19)34-3)8-16(12-23)21(27)24-6-7-33-2/h4-5,8-11H,6-7H2,1-3H3,(H,24,27)/b16-8+
C22H20N4O9484.41564300
34603404
InChI=1/C22H20N4O9/c1-34-20(29)12-4-6-15(21(30)35-2)17(10-12)24-22(31)23-8-3-9-25-18(27)14-7-5-13(26(32)33)11-16(14)19(25)28/h4-7,10-11H,3,8-9H2,1-2H3,(H2,23,24,31)
C22H20N4O9484.41563200
34650108
InChI=1/C22H20N4O9/c1-2-34-22(31)35-15-6-3-13(4-7-15)19(28)24-10-9-23-18(27)12-25-20(29)16-8-5-14(26(32)33)11-17(16)21(25)30/h3-8,11H,2,9-10,12H2,1H3,(H,23,27)(H,24,28)
C22H20N4O9484.41563200
5200206

Double-bond stereo
InChI=1/C22H20N4O9/c1-9-7-13(27)17(21(31)33-9)11(3)23-25-19(29)15-5-6-16(35-15)20(30)26-24-12(4)18-14(28)8-10(2)34-22(18)32/h5-8,23-24H,1-4H3,(H,25,29)(H,26,30)
C22H20N4O9484.41563200
68290166

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20N4O9/c1-34-21(30)13-6-8-15(9-7-13)23-18(27)12-35-22(31)14-10-19(28)25(11-14)24-20(29)16-4-2-3-5-17(16)26(32)33/h2-9,14H,10-12H2,1H3,(H,23,27)(H,24,29)
C22H20N4O9484.41562100
68290177

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20N4O9/c1-34-21(30)14-2-6-16(7-3-14)23-18(27)12-35-22(31)15-10-19(28)25(11-15)24-20(29)13-4-8-17(9-5-13)26(32)33/h2-9,15H,10-12H2,1H3,(H,23,27)(H,24,29)
C22H20N4O9484.41562100
95678447

Double-bond stereo
InChI=1/C22H20N4O9/c1-11(27)21(12(2)28)17-7-5-15(9-19(17)25(32)33)23-24(31)16-6-8-18(20(10-16)26(34)35)22(13(3)29)14(4)30/h5-10,22,31H,1-4H3/b23-15+
C22H20N4O9484.41561100
101073273

Double-bond stereo
InChI=1/C22H20N4O9/c1-31-15-6-4-13(5-7-15)16-9-20(35-25-16)22(28)24-23-11-14-8-18(32-2)19(10-17(14)26(29)30)34-12-21(27)33-3/h4-11H,12H2,1-3H3,(H,24,28)/b23-11-
C22H20N4O9484.41561100
101090808

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20N4O9/c1-31-18-6-12(7-19-20(18)34-11-33-19)5-15-9-16(25-35-15)21(27)24-23-10-14-4-3-13(22(28)32-2)8-17(14)26(29)30/h3-4,6-8,10,15H,5,9,11H2,1-2H3,(H,24,27)/b23-10-
C22H20N4O9484.41561100
101090875

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20N4O9/c1-31-18-6-12(7-19-20(18)34-11-33-19)5-15-9-16(25-35-15)21(27)24-23-10-14-8-13(22(28)32-2)3-4-17(14)26(29)30/h3-4,6-8,10,15H,5,9,11H2,1-2H3,(H,24,27)/b23-10-
C22H20N4O9484.41561100
101092354

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20N4O9/c1-31-18-6-12(7-19-20(18)34-11-33-19)5-16-9-17(25-35-16)21(27)24-23-10-13-3-14(22(28)32-2)8-15(4-13)26(29)30/h3-4,6-8,10,16H,5,9,11H2,1-2H3,(H,24,27)/b23-10-
C22H20N4O9484.41561100
101092643

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20N4O9/c1-31-17-7-12(8-18-20(17)34-11-33-18)6-14-9-15(25-35-14)21(27)24-23-10-13-4-3-5-16(26(29)30)19(13)22(28)32-2/h3-5,7-8,10,14H,6,9,11H2,1-2H3,(H,24,27)/b23-10-
C22H20N4O9484.41561100
101092710

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20N4O9/c1-31-17-7-12(8-18-20(17)34-11-33-18)6-14-9-16(25-35-14)21(27)24-23-10-13-4-3-5-15(22(28)32-2)19(13)26(29)30/h3-5,7-8,10,14H,6,9,11H2,1-2H3,(H,24,27)/b23-10-
C22H20N4O9484.41561100
103279835

Double-bond stereo
InChI=1/C22H20N4O9/c1-31-15-6-4-13(5-7-15)18-9-16(25-35-18)22(28)24-23-11-14-8-19(32-2)20(10-17(14)26(29)30)34-12-21(27)33-3/h4-11H,12H2,1-3H3,(H,24,28)/b23-11-
C22H20N4O9484.41561100
120072901
InChI=1/C22H20N4O9/c27-20-17-3-1-4-18(19(17)21(28)24(20)6-2-5-23-7-9-34-10-8-23)35-22(29)14-11-15(25(30)31)13-16(12-14)26(32)33/h1,3-4,11-13H,2,5-10H2
C22H20N4O9484.41561100
123247590

Double-bond stereo
InChI=1/C22H20N4O9/c1-11(27)21(12(2)28)17-7-5-15(9-19(17)25(32)33)23-24(31)16-6-8-18(20(10-16)26(34)35)22(13(3)29)14(4)30/h5-10,27,29H,1-4H3/b21-11-,22-13u,24-23u
C22H20N4O9484.41561100
57542043

Double-bond stereo
InChI=1/C22H20N4O9/c1-11(27)21(12(2)28)17-7-5-15(9-19(17)25(32)33)23-24(31)16-6-8-18(20(10-16)26(34)35)22(13(3)29)14(4)30/h5-10,29,31H,1-4H3
C22H20N4O9484.41561100
12

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