3-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)-2-phenoxy-butanoic acid

Systemtic Name: 3-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)-2-phenoxy-butanoic acid Openeye Name: 3-[4-(naphthalene-2-carbonyl)piperazin-1-yl]-2-phenoxy-butanoic acid CAS Name: 3-[4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]-2-phenoxybutanoic acid IUPAC Name: 3-[4-(naphthalene-2-carbonyl)piperazin-1-yl]-2-phenoxybutanoic acid Traditional Name: 3-[4-(2-naphthoyl)piperazino]-2-phenoxy-butyric acid Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)OC1=CC=CC=C1)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C(C(=O)O)OC1=CC=CC=C1)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H26N2O4/c1-18(23(25(29)30)31-22-9-3-2-4-10-22)26-13-15-27(16-14-26)24(28)21-12-11-19-7-5-6-8-20(19)17-21/h2-12,17-18,23H,13-16H2,1H3,(H,29,30)