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 6 results

Search term: UPMJXBLRDCBHGF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
834181

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21NO2/c1-13(15-7-5-4-6-8-15)18-12-14-9-10-16(19-2)17(11-14)20-3/h4-11,13,18H,12H2,1-3H3/t13-/m1/s1
C17H21NO2271.3541524300
834182

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21NO2/c1-13(15-7-5-4-6-8-15)18-12-14-9-10-16(19-2)17(11-14)20-3/h4-11,13,18H,12H2,1-3H3/t13-/m0/s1
C17H21NO2271.3541401900
2039160

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H21NO2/c1-13(15-7-5-4-6-8-15)18-12-14-9-10-16(19-2)17(11-14)20-3/h4-11,13,18H,12H2,1-3H3
C17H21NO2271.35414332800
5329119

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21NO2/c1-13(15-7-5-4-6-8-15)18-12-14-9-10-16(19-2)17(11-14)20-3/h4-11,13,18H,12H2,1-3H3/p+1/t13-/m1/s1
C17H22NO2272.362083200
95677913

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H21NO2/c1-13(15-7-5-4-6-8-15)18-12-14-9-10-16(19-2)17(11-14)20-3/h4-11,13,18H,12H2,1-3H3/p+1
C17H22NO2272.36151100
5329118

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21NO2/c1-13(15-7-5-4-6-8-15)18-12-14-9-10-16(19-2)17(11-14)20-3/h4-11,13,18H,12H2,1-3H3/p+1/t13-/m0/s1
C17H22NO2272.362081100

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