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 4 results

Search term: PBYHWKJRJDNBLE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9740805

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H24O3/c1-13(2)18-10-7-14(3)5-4-6-15-8-9-16-11-17(22)12-19(18)20(16)24-21(15)23/h5,8,11-12,18,22H,1,4,6-7,9-10H2,2-3H3/b14-5-
C21H24O3324.41353200
28283218

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H24O3/c1-13(2)18-10-7-14(3)5-4-6-15-8-9-16-11-17(22)12-19(18)20(16)24-21(15)23/h5,8,11-12,18,22H,1,4,6-7,9-10H2,2-3H3/b14-5+/t18-/m0/s1
C21H24O3324.41353400
9100633

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H24O3/c1-13(2)18-10-7-14(3)5-4-6-15-8-9-16-11-17(22)12-19(18)20(16)24-21(15)23/h5,8,11-12,18,22H,1,4,6-7,9-10H2,2-3H3/b14-5-/t18-/m0/s1
C21H24O3324.41352100
10272731

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H24O3/c1-13(2)18-10-7-14(3)5-4-6-15-8-9-16-11-17(22)12-19(18)20(16)24-21(15)23/h5,8,11-12,18,22H,1,4,6-7,9-10H2,2-3H3/b14-5+
C21H24O3324.41351100

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