2-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)-2-phenyl-butanoic acid

Systemtic Name: 2-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)-2-phenyl-butanoic acid Openeye Name: 2-[4-(naphthalene-2-carbonyl)piperazin-1-yl]-2-phenyl-butanoic acid CAS Name: 2-[4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]-2-phenylbutanoic acid IUPAC Name: 2-[4-(naphthalene-2-carbonyl)piperazin-1-yl]-2-phenylbutanoic acid Traditional Name: 2-[4-(2-naphthoyl)piperazino]-2-phenyl-butyric acid Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)(C(=O)O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCC(C1=CC=CC=C1)(C(=O)O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H26N2O3/c1-2-25(24(29)30,22-10-4-3-5-11-22)27-16-14-26(15-17-27)23(28)21-13-12-19-8-6-7-9-20(19)18-21/h3-13,18H,2,14-17H2,1H3,(H,29,30)