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

Systemtic Name: 4-[5-(4-methylphenyl)-3-(2-phenylethenyl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-oxo-4-[5-(p-tolyl)-3-styryl-3,4-dihydropyrazol-2-yl]butanoic acid CAS Name: 4-[5-(4-methylphenyl)-3-(2-phenylethenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid IUPAC Name: 4-[5-(4-methylphenyl)-3-(2-phenylethenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[3-(p-tolyl)-5-styryl-2-pyrazolin-1-yl]butyric acid Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(C2)C=CC3=CC=CC=C3)C(=O)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(C2)C=CC3=CC=CC=C3)C(=O)CCC(=O)O

InChI

InChI=1S/C22H22N2O3/c1-16-7-10-18(11-8-16)20-15-19(12-9-17-5-3-2-4-6-17)24(23-20)21(25)13-14-22(26)27/h2-12,19H,13-15H2,1H3,(H,26,27)