2-[[[4-butyl-3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]-phenyl-methyl]amino]benzoic acid

Systemtic Name: 2-[[[4-butyl-3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]-phenyl-methyl]amino]benzoic acid Openeye Name: 2-[[(4-butyl-3,5-dioxo-1,2-diphenyl-pyrazolidin-4-yl)-phenyl-methyl]amino]benzoic acid CAS Name: 2-[[(4-butyl-3,5-dioxo-1,2-diphenyl-4-pyrazolidinyl)-phenylmethyl]amino]benzoic acid IUPAC Name: 2-[[(4-butyl-3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)-phenylmethyl]amino]benzoic acid Traditional Name: 2-[[(4-butyl-3,5-diketo-1,2-diphenyl-pyrazolidin-4-yl)-phenyl-methyl]amino]benzoic acid Formula: C33H31N3O4 MolecularWeight: 533.61694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)C(C4=CC=CC=C4)NC5=CC=CC=C5C(=O)O

Isomeric SMILES

CCCCC1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)C(C4=CC=CC=C4)NC5=CC=CC=C5C(=O)O

InChI

InChI=1S/C33H31N3O4/c1-2-3-23-33(29(24-15-7-4-8-16-24)34-28-22-14-13-21-27(28)30(37)38)31(39)35(25-17-9-5-10-18-25)36(32(33)40)26-19-11-6-12-20-26/h4-22,29,34H,2-3,23H2,1H3,(H,37,38)