4-[5-(4-chlorophenyl)-3-(2-phenylethenyl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-(4-chlorophenyl)-3-(2-phenylethenyl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-(4-chlorophenyl)-3-styryl-3,4-dihydropyrazol-2-yl]-4-oxo-butanoic acid CAS Name: 4-[5-(4-chlorophenyl)-3-(2-phenylethenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid IUPAC Name: 4-[5-(4-chlorophenyl)-3-(2-phenylethenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid Traditional Name: 4-[3-(4-chlorophenyl)-5-styryl-2-pyrazolin-1-yl]-4-keto-butyric acid Formula: C21H19ClN2O3 MolecularWeight: 382.84016

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=C(C=C2)Cl)C(=O)CCC(=O)O)C=CC3=CC=CC=C3

Isomeric SMILES

C1C(N(N=C1C2=CC=C(C=C2)Cl)C(=O)CCC(=O)O)C=CC3=CC=CC=C3

InChI

InChI=1S/C21H19ClN2O3/c22-17-9-7-16(8-10-17)19-14-18(11-6-15-4-2-1-3-5-15)24(23-19)20(25)12-13-21(26)27/h1-11,18H,12-14H2,(H,26,27)