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
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Found 6 results

Search term: BCDZFRFUONYLNC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4894400

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H17NO5/c22-19-15-9-8-14(26-20(23)16-7-4-10-21-16)11-17(15)24-12-18(19)25-13-5-2-1-3-6-13/h1-3,5-6,8-9,11-12,16,21H,4,7,10H2/t16-/m0/s1
C20H17NO5351.35274300
5430723

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H17NO5/c22-19-15-9-8-14(26-20(23)16-7-4-10-21-16)11-17(15)24-12-18(19)25-13-5-2-1-3-6-13/h1-3,5-6,8-9,11-12,16,21H,4,7,10H2/p+1/t16-/m0/s1
C20H18NO5352.36013100
1394584

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H17NO5/c22-19-15-9-8-14(26-20(23)16-7-4-10-21-16)11-17(15)24-12-18(19)25-13-5-2-1-3-6-13/h1-3,5-6,8-9,11-12,16,21H,4,7,10H2/t16-/m1/s1
C20H17NO5351.35272100
2528061

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H17NO5/c22-19-15-9-8-14(26-20(23)16-7-4-10-21-16)11-17(15)24-12-18(19)25-13-5-2-1-3-6-13/h1-3,5-6,8-9,11-12,16,21H,4,7,10H2
C20H17NO5351.35272100
1394583

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H17NO5/c22-19-15-9-8-14(26-20(23)16-7-4-10-21-16)11-17(15)24-12-18(19)25-13-5-2-1-3-6-13/h1-3,5-6,8-9,11-12,16,21H,4,7,10H2/p+1/t16-/m1/s1
C20H18NO5352.36011100
2528060

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H17NO5/c22-19-15-9-8-14(26-20(23)16-7-4-10-21-16)11-17(15)24-12-18(19)25-13-5-2-1-3-6-13/h1-3,5-6,8-9,11-12,16,21H,4,7,10H2/p+1
C20H18NO5352.36011100

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