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

Systemtic Name: 1-[(3-methoxy-4-phenylmethoxy-phenyl)-naphthalen-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)-(2-naphthyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)-(2-naphthalenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)-naphthalen-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-methoxy-phenyl)-(2-naphthyl)methyl]pipecolinic acid Formula: C31H31NO4 MolecularWeight: 481.58214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCCCC4C(=O)O)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCCCC4C(=O)O)OCC5=CC=CC=C5

InChI

InChI=1S/C31H31NO4/c1-35-29-20-26(16-17-28(29)36-21-22-9-3-2-4-10-22)30(32-18-8-7-13-27(32)31(33)34)25-15-14-23-11-5-6-12-24(23)19-25/h2-6,9-12,14-17,19-20,27,30H,7-8,13,18,21H2,1H3,(H,33,34)