1-[(3-ethoxy-4-phenylmethoxy-phenyl)-naphthalen-2-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3-ethoxy-4-phenylmethoxy-phenyl)-naphthalen-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-ethoxy-phenyl)-(2-naphthyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-(2-naphthalenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-naphthalen-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-ethoxy-phenyl)-(2-naphthyl)methyl]pipecolinic acid Formula: C32H33NO4 MolecularWeight: 495.60872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCCCC4C(=O)O)OCC5=CC=CC=C5

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCCCC4C(=O)O)OCC5=CC=CC=C5

InChI

InChI=1S/C32H33NO4/c1-2-36-30-21-27(17-18-29(30)37-22-23-10-4-3-5-11-23)31(33-19-9-8-14-28(33)32(34)35)26-16-15-24-12-6-7-13-25(24)20-26/h3-7,10-13,15-18,20-21,28,31H,2,8-9,14,19,22H2,1H3,(H,34,35)