4-[[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(4-benzhydrylpiperazine-1-carbonyl)anilino]-4-oxo-butanoic acid CAS Name: 4-[2-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]anilino]-4-oxobutanoic acid IUPAC Name: 4-[2-(4-benzhydrylpiperazine-1-carbonyl)anilino]-4-oxobutanoic acid Traditional Name: 4-[2-(4-benzhydrylpiperazine-1-carbonyl)anilino]-4-keto-butyric acid Formula: C28H29N3O4 MolecularWeight: 471.54756

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4NC(=O)CCC(=O)O

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4NC(=O)CCC(=O)O

InChI

InChI=1S/C28H29N3O4/c32-25(15-16-26(33)34)29-24-14-8-7-13-23(24)28(35)31-19-17-30(18-20-31)27(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-14,27H,15-20H2,(H,29,32)(H,33,34)