4-[(3R)-3-(2-hydroxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3R)-3-(2-hydroxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(3R)-3-(2-hydroxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxo-butanoate CAS Name: 4-[(3R)-3-(2-hydroxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoate IUPAC Name: 4-[(3R)-3-(2-hydroxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoate Traditional Name: 4-[(5R)-5-(2-hydroxyphenyl)-3-phenyl-2-pyrazolin-1-yl]-4-keto-butyrate Formula: C19H17N2O4- MolecularWeight: 337.34928

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CC=C2)C(=O)CCC(=O)[O-])C3=CC=CC=C3O

Isomeric SMILES

C1[C@@H](N(N=C1C2=CC=CC=C2)C(=O)CCC(=O)[O-])C3=CC=CC=C3O

InChI

InChI=1S/C19H18N2O4/c22-17-9-5-4-8-14(17)16-12-15(13-6-2-1-3-7-13)20-21(16)18(23)10-11-19(24)25/h1-9,16,22H,10-12H2,(H,24,25)/p-1/t16-/m1/s1