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: XPTMIANDLJCJSL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
228458

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H26N2O3/c1-24-19-8-5-9-20(14-19)25-16-18(23)15-21-10-12-22(13-11-21)17-6-3-2-4-7-17/h2-9,14,18,23H,10-13,15-16H2,1H3
C20H26N2O3342.432261900
669009

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H26N2O3/c1-24-19-8-5-9-20(14-19)25-16-18(23)15-21-10-12-22(13-11-21)17-6-3-2-4-7-17/h2-9,14,18,23H,10-13,15-16H2,1H3/t18-/m1/s1
C20H26N2O3342.4322100
669011

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H26N2O3/c1-24-19-8-5-9-20(14-19)25-16-18(23)15-21-10-12-22(13-11-21)17-6-3-2-4-7-17/h2-9,14,18,23H,10-13,15-16H2,1H3/t18-/m0/s1
C20H26N2O3342.4322100
5313727

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H26N2O3/c1-24-19-8-5-9-20(14-19)25-16-18(23)15-21-10-12-22(13-11-21)17-6-3-2-4-7-17/h2-9,14,18,23H,10-13,15-16H2,1H3/p+1/t18-/m1/s1
C20H27N2O3343.439982200
5313728

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H26N2O3/c1-24-19-8-5-9-20(14-19)25-16-18(23)15-21-10-12-22(13-11-21)17-6-3-2-4-7-17/h2-9,14,18,23H,10-13,15-16H2,1H3/p+1/t18-/m0/s1
C20H27N2O3343.439982200
3372812

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H26N2O3/c1-24-19-8-5-9-20(14-19)25-16-18(23)15-21-10-12-22(13-11-21)17-6-3-2-4-7-17/h2-9,14,18,23H,10-13,15-16H2,1H3/p+1
C20H27N2O3343.439981100

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