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: YRTYDLGZBIUHCB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
563187

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H32N6O3/c1-25-9-11-26(12-10-25)19(21-22-23-24-27(21)16-7-5-6-8-16)15-13-17(28-2)20(30-4)18(14-15)29-3/h13-14,16,19H,5-12H2,1-4H3
C21H32N6O3416.517212800
1193208

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H32N6O3/c1-25-9-11-26(12-10-25)19(21-22-23-24-27(21)16-7-5-6-8-16)15-13-17(28-2)20(30-4)18(14-15)29-3/h13-14,16,19H,5-12H2,1-4H3/t19-/m0/s1
C21H32N6O3416.51722100
1193210

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H32N6O3/c1-25-9-11-26(12-10-25)19(21-22-23-24-27(21)16-7-5-6-8-16)15-13-17(28-2)20(30-4)18(14-15)29-3/h13-14,16,19H,5-12H2,1-4H3/t19-/m1/s1
C21H32N6O3416.51722100
5354613

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H32N6O3/c1-25-9-11-26(12-10-25)19(21-22-23-24-27(21)16-7-5-6-8-16)15-13-17(28-2)20(30-4)18(14-15)29-3/h13-14,16,19H,5-12H2,1-4H3/p+2/t19-/m0/s1
C21H34N6O3418.5321100
5354614

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H32N6O3/c1-25-9-11-26(12-10-25)19(21-22-23-24-27(21)16-7-5-6-8-16)15-13-17(28-2)20(30-4)18(14-15)29-3/h13-14,16,19H,5-12H2,1-4H3/p+2/t19-/m1/s1
C21H34N6O3418.5321100

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