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: UMUQEBKAAMLAQO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2050839

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H27ClN2O2/c22-20-8-6-19(7-9-20)16-26-17-21(25)15-24-12-10-23(11-13-24)14-18-4-2-1-3-5-18/h1-9,21,25H,10-17H2
C21H27ClN2O2374.90428141100
1512654

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H27ClN2O2/c22-20-8-6-19(7-9-20)16-26-17-21(25)15-24-12-10-23(11-13-24)14-18-4-2-1-3-5-18/h1-9,21,25H,10-17H2/t21-/m0/s1
C21H27ClN2O2374.90432100
1542520

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H27ClN2O2/c22-20-8-6-19(7-9-20)16-26-17-21(25)15-24-12-10-23(11-13-24)14-18-4-2-1-3-5-18/h1-9,21,25H,10-17H2/t21-/m1/s1
C21H27ClN2O2374.90432100
1512653

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H27ClN2O2/c22-20-8-6-19(7-9-20)16-26-17-21(25)15-24-12-10-23(11-13-24)14-18-4-2-1-3-5-18/h1-9,21,25H,10-17H2/p+2/t21-/m0/s1
C21H29ClN2O2376.91911100
1542519

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H27ClN2O2/c22-20-8-6-19(7-9-20)16-26-17-21(25)15-24-12-10-23(11-13-24)14-18-4-2-1-3-5-18/h1-9,21,25H,10-17H2/p+2/t21-/m1/s1
C21H29ClN2O2376.91911100

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