[5-oxidanylidene-4-(3-oxidanylidenebutyl)-1,2-diphenyl-pyrazol-3-yl] benzoate

Systemtic Name: [5-oxidanylidene-4-(3-oxidanylidenebutyl)-1,2-diphenyl-pyrazol-3-yl] benzoate Openeye Name: [5-oxo-4-(3-oxobutyl)-1,2-diphenyl-pyrazol-3-yl] benzoate CAS Name: benzoic acid [5-oxo-4-(3-oxobutyl)-1,2-diphenyl-3-pyrazolyl] ester IUPAC Name: [5-oxo-4-(3-oxobutyl)-1,2-diphenylpyrazol-3-yl] benzoate Traditional Name: benzoic acid [5-keto-4-(3-ketobutyl)-1,2-diphenyl-3-pyrazolin-3-yl] ester Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=C(N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)CCC1=C(N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H22N2O4/c1-19(29)17-18-23-24(30)27(21-13-7-3-8-14-21)28(22-15-9-4-10-16-22)25(23)32-26(31)20-11-5-2-6-12-20/h2-16H,17-18H2,1H3