1-[(3,5-dimethoxy-4-phenylmethoxy-phenyl)-phenyl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3,5-dimethoxy-4-phenylmethoxy-phenyl)-phenyl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3,5-dimethoxy-phenyl)-phenyl-methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,5-dimethoxy-4-phenylmethoxyphenyl)-phenylmethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,5-dimethoxy-4-phenylmethoxyphenyl)-phenylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3,5-dimethoxy-phenyl)-phenyl-methyl]pipecolinic acid Formula: C28H31NO5 MolecularWeight: 461.54944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(C3=CC=CC=C3)N4CCCCC4C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(C3=CC=CC=C3)N4CCCCC4C(=O)O

InChI

InChI=1S/C28H31NO5/c1-32-24-17-22(18-25(33-2)27(24)34-19-20-11-5-3-6-12-20)26(21-13-7-4-8-14-21)29-16-10-9-15-23(29)28(30)31/h3-8,11-14,17-18,23,26H,9-10,15-16,19H2,1-2H3,(H,30,31)