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: JIWITVPPKVEKGX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2210237

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H22N2O2/c1-14-7-8-15(2)18(11-14)23-20(24)12-19(21(23)25)22-10-9-16-5-3-4-6-17(16)13-22/h3-8,11,19H,9-10,12-13H2,1-2H3
C21H22N2O2334.41158281900
776767

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H22N2O2/c1-14-7-8-15(2)18(11-14)23-20(24)12-19(21(23)25)22-10-9-16-5-3-4-6-17(16)13-22/h3-8,11,19H,9-10,12-13H2,1-2H3/t19-/m1/s1
C21H22N2O2334.41162100
776768

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H22N2O2/c1-14-7-8-15(2)18(11-14)23-20(24)12-19(21(23)25)22-10-9-16-5-3-4-6-17(16)13-22/h3-8,11,19H,9-10,12-13H2,1-2H3/t19-/m0/s1
C21H22N2O2334.41162100
5325733

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H22N2O2/c1-14-7-8-15(2)18(11-14)23-20(24)12-19(21(23)25)22-10-9-16-5-3-4-6-17(16)13-22/h3-8,11,19H,9-10,12-13H2,1-2H3/p+1/t19-/m1/s1
C21H23N2O2335.419521100
5325734

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H22N2O2/c1-14-7-8-15(2)18(11-14)23-20(24)12-19(21(23)25)22-10-9-16-5-3-4-6-17(16)13-22/h3-8,11,19H,9-10,12-13H2,1-2H3/p+1/t19-/m0/s1
C21H23N2O2335.419521100

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