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

Systemtic Name: 2-(1-naphthalen-2-ylcarbonylpiperidin-4-yl)-2-phenoxy-butanoic acid Openeye Name: 2-[1-(naphthalene-2-carbonyl)-4-piperidyl]-2-phenoxy-butanoic acid CAS Name: 2-[1-[2-naphthalenyl(oxo)methyl]-4-piperidinyl]-2-phenoxybutanoic acid IUPAC Name: 2-[1-(naphthalene-2-carbonyl)piperidin-4-yl]-2-phenoxybutanoic acid Traditional Name: 2-[1-(2-naphthoyl)-4-piperidyl]-2-phenoxy-butyric acid Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCN(CC1)C(=O)C2=CC3=CC=CC=C3C=C2)(C(=O)O)OC4=CC=CC=C4

Isomeric SMILES

CCC(C1CCN(CC1)C(=O)C2=CC3=CC=CC=C3C=C2)(C(=O)O)OC4=CC=CC=C4

InChI

InChI=1S/C26H27NO4/c1-2-26(25(29)30,31-23-10-4-3-5-11-23)22-14-16-27(17-15-22)24(28)21-13-12-19-8-6-7-9-20(19)18-21/h3-13,18,22H,2,14-17H2,1H3,(H,29,30)