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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1CC2=CC=CC=C2CC3=CC=CC=C3)CCCC(=O)O

Isomeric SMILES

C1CN(C(=O)CN1CC2=CC=CC=C2CC3=CC=CC=C3)CCCC(=O)O

InChI

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