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

Systemtic Name: 2-(4-naphthalen-1-ylcarbonylpiperazin-1-yl)-2-phenoxy-butanoic acid Openeye Name: 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenoxy-butanoic acid CAS Name: 2-[4-[1-naphthalenyl(oxo)methyl]-1-piperazinyl]-2-phenoxybutanoic acid IUPAC Name: 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenoxybutanoic acid Traditional Name: 2-[4-(1-naphthoyl)piperazino]-2-phenoxy-butyric acid Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)(N1CCN(CC1)C(=O)C2=CC=CC3=CC=CC=C32)OC4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)O)(N1CCN(CC1)C(=O)C2=CC=CC3=CC=CC=C32)OC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O4/c1-2-25(24(29)30,31-20-11-4-3-5-12-20)27-17-15-26(16-18-27)23(28)22-14-8-10-19-9-6-7-13-21(19)22/h3-14H,2,15-18H2,1H3,(H,29,30)