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 5 results

Search term: AWNZZCYMJHJGTF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
540430

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C18H20N6O/c1-22-16(25)23(2)18(14-11-7-4-8-12-14)17(22,21-15(19)24(18)20)13-9-5-3-6-10-13/h3-12H,20H2,1-2H3,(H2,19,21)
C18H20N6O336.391181500
5603604

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H20N6O/c1-22-16(25)23(2)18(14-11-7-4-8-12-14)17(22,21-15(19)24(18)20)13-9-5-3-6-10-13/h3-12H,20H2,1-2H3,(H2,19,21)/p+1/t17-,18+/m1/s1
C18H21N6O337.39842100
5603605

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H20N6O/c1-22-16(25)23(2)18(14-11-7-4-8-12-14)17(22,21-15(19)24(18)20)13-9-5-3-6-10-13/h3-12H,20H2,1-2H3,(H2,19,21)/p+1/t17-,18-/m1/s1
C18H21N6O337.39842100
62572642

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H20N6O/c1-22-16(25)23(2)18(14-11-7-4-8-12-14)17(22,21-15(19)24(18)20)13-9-5-3-6-10-13/h3-12H,20H2,1-2H3,(H2,19,21)/t17-,18+/m1/s1
C18H20N6O336.3912300
60499092

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C18H20N6O/c1-22-16(25)23(2)18(14-11-7-4-8-12-14)17(22,21-15(19)24(18)20)13-9-5-3-6-10-13/h3-12H,20H2,1-2H3,(H2,19,21)/t17-,18?/m1/s1
C18H20N6O336.3911100

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