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: WIPFLHRMYUMKKE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2168950

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H14O5/c22-20(23)19(13-6-2-1-3-7-13)25-14-10-11-16-15-8-4-5-9-17(15)21(24)26-18(16)12-14/h1-12,19H,(H,22,23)
C21H14O5346.33286231500
769402

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H14O5/c22-20(23)19(13-6-2-1-3-7-13)25-14-10-11-16-15-8-4-5-9-17(15)21(24)26-18(16)12-14/h1-12,19H,(H,22,23)/t19-/m0/s1
C21H14O5346.33292100
769403

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H14O5/c22-20(23)19(13-6-2-1-3-7-13)25-14-10-11-16-15-8-4-5-9-17(15)21(24)26-18(16)12-14/h1-12,19H,(H,22,23)/t19-/m1/s1
C21H14O5346.33292100
5761696

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H14O5/c22-20(23)19(13-6-2-1-3-7-13)25-14-10-11-16-15-8-4-5-9-17(15)21(24)26-18(16)12-14/h1-12,19H,(H,22,23)/p-1/t19-/m0/s1
C21H13O5345.32551100
5761697

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H14O5/c22-20(23)19(13-6-2-1-3-7-13)25-14-10-11-16-15-8-4-5-9-17(15)21(24)26-18(16)12-14/h1-12,19H,(H,22,23)/p-1/t19-/m1/s1
C21H13O5345.32551100

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