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: WRFIQSLSDHSYOQ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
20077155

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H23N3O3/c1-3-12-22-18-6-4-5-7-19(18)23(20(22)21)13-15(24)14-26-17-10-8-16(25-2)9-11-17/h3-11,15,21,24H,1,12-14H2,2H3
C20H23N3O3353.4149111100
2225369

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H23N3O3/c1-3-12-22-18-6-4-5-7-19(18)23(20(22)21)13-15(24)14-26-17-10-8-16(25-2)9-11-17/h3-11,15,21,24H,1,12-14H2,2H3/b21-20+
C20H23N3O3353.414924200
4057276

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H23N3O3/c1-3-12-22-18-6-4-5-7-19(18)23(20(22)21)13-15(24)14-26-17-10-8-16(25-2)9-11-17/h3-11,15,21,24H,1,12-14H2,2H3/p+1
C20H24N3O3354.422862100
5406274

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H23N3O3/c1-3-12-22-18-6-4-5-7-19(18)23(20(22)21)13-15(24)14-26-17-10-8-16(25-2)9-11-17/h3-11,15,21,24H,1,12-14H2,2H3/p+1/t15-/m0/s1
C20H24N3O3354.42232100
1166824

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H23N3O3/c1-3-12-22-18-6-4-5-7-19(18)23(20(22)21)13-15(24)14-26-17-10-8-16(25-2)9-11-17/h3-11,15,21,24H,1,12-14H2,2H3/p+1/t15-/m1/s1
C20H24N3O3354.42232100

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