4-[3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]butanoyl benzoate

Systemtic Name: 4-[3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]butanoyl benzoate Openeye Name: 4-(3,5-dioxo-1,2-diphenyl-pyrazolidin-4-yl)butanoyl benzoate CAS Name: benzoic acid [4-(3,5-dioxo-1,2-diphenyl-4-pyrazolidinyl)-1-oxobutyl] ester IUPAC Name: 4-(3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)butanoyl benzoate Traditional Name: benzoic acid 4-(3,5-diketo-1,2-diphenyl-pyrazolidin-4-yl)butanoyl ester Formula: C26H22N2O5 MolecularWeight: 442.46328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC(=O)CCCC2C(=O)N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC(=O)CCCC2C(=O)N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H22N2O5/c29-23(33-26(32)19-11-4-1-5-12-19)18-10-17-22-24(30)27(20-13-6-2-7-14-20)28(25(22)31)21-15-8-3-9-16-21/h1-9,11-16,22H,10,17-18H2