Matches any text strings used to describe a molecule.
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
Additional Filters

Found 8 results

Search term: GYRDVQBCFXEYGD (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2169601

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H16N4O/c25-20-16(7-6-14-4-3-11-23-19(14)20)18(15-8-12-21-13-9-15)24-17-5-1-2-10-22-17/h1-13,18,25H,(H,22,24)
C20H16N4O328.36724261600
613167

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H16N4O/c25-20-16(7-6-14-4-3-11-23-19(14)20)18(15-8-12-21-13-9-15)24-17-5-1-2-10-22-17/h1-13,18,25H,(H,22,24)/t18-/m0/s1
C20H16N4O328.36722100
613171

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H16N4O/c25-20-16(7-6-14-4-3-11-23-19(14)20)18(15-8-12-21-13-9-15)24-17-5-1-2-10-22-17/h1-13,18,25H,(H,22,24)/t18-/m1/s1
C20H16N4O328.36722100
2865494

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H16N4O/c25-20-16(7-6-14-4-3-11-23-19(14)20)18(15-8-12-21-13-9-15)24-17-5-1-2-10-22-17/h1-13,18,25H,(H,22,24)/p+1
C20H17N4O329.375181300
2865496

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H16N4O/c25-20-16(7-6-14-4-3-11-23-19(14)20)18(15-8-12-21-13-9-15)24-17-5-1-2-10-22-17/h1-13,18,25H,(H,22,24)/p+2
C20H18N4O330.383121300
2865834

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H16N4O/c25-20-16(7-6-14-4-3-11-23-19(14)20)18(15-8-12-21-13-9-15)24-17-5-1-2-10-22-17/h1-13,18,25H,(H,22,24)/p+3
C20H19N4O331.391061100
5298570

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H16N4O/c25-20-16(7-6-14-4-3-11-23-19(14)20)18(15-8-12-21-13-9-15)24-17-5-1-2-10-22-17/h1-13,18,25H,(H,22,24)/p+1/t18-/m0/s1
C20H17N4O329.375181100
5298572

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H16N4O/c25-20-16(7-6-14-4-3-11-23-19(14)20)18(15-8-12-21-13-9-15)24-17-5-1-2-10-22-17/h1-13,18,25H,(H,22,24)/p+1/t18-/m1/s1
C20H17N4O329.375181100

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