4-oxidanylidene-4-[4-[[2-(phenylmethyl)phenyl]methyl]piperazin-1-yl]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[4-[[2-(phenylmethyl)phenyl]methyl]piperazin-1-yl]butanoic acid Openeye Name: 4-[4-[(2-benzylphenyl)methyl]piperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-oxo-4-[4-[[2-(phenylmethyl)phenyl]methyl]-1-piperazinyl]butanoic acid IUPAC Name: 4-[4-[(2-benzylphenyl)methyl]piperazin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[4-(2-benzylbenzyl)piperazino]-4-keto-butyric acid Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2CC3=CC=CC=C3)C(=O)CCC(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2CC3=CC=CC=C3)C(=O)CCC(=O)O

InChI

InChI=1S/C22H26N2O3/c25-21(10-11-22(26)27)24-14-12-23(13-15-24)17-20-9-5-4-8-19(20)16-18-6-2-1-3-7-18/h1-9H,10-17H2,(H,26,27)