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: QWRXZMZNXDPEAR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3233945

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C21H27N3/c1-14(21-10-15-7-16(11-21)9-17(8-15)12-21)22-13-20-23-18-5-3-4-6-19(18)24(20)2/h3-6,13-17H,7-12H2,1-2H3/b22-13+
C21H27N3321.4592141100
22906587

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C21H27N3/c1-14(21-10-15-7-16(11-21)9-17(8-15)12-21)22-13-20-23-18-5-3-4-6-19(18)24(20)2/h3-6,13-17H,7-12H2,1-2H3/b22-13-
C21H27N3321.45927500
5421464

Double-bond stereo

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C21H27N3/c1-14(21-10-15-7-16(11-21)9-17(8-15)12-21)22-13-20-23-18-5-3-4-6-19(18)24(20)2/h3-6,13-17H,7-12H2,1-2H3/b22-13+/t14-,15?,16?,17?,21?/m0/s1
C21H27N3321.45922100
5421465

Double-bond stereo

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C21H27N3/c1-14(21-10-15-7-16(11-21)9-17(8-15)12-21)22-13-20-23-18-5-3-4-6-19(18)24(20)2/h3-6,13-17H,7-12H2,1-2H3/b22-13+/t14-,15?,16?,17?,21?/m1/s1
C21H27N3321.45922100

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