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

Systemtic Name: 1-[1-(3,5-dimethoxy-4-phenylmethoxy-phenyl)-2-pyridin-2-yl-ethyl]piperidine-2-carboxylic acid Openeye Name: 1-[1-(4-benzyloxy-3,5-dimethoxy-phenyl)-2-(2-pyridyl)ethyl]piperidine-2-carboxylic acid CAS Name: 1-[1-(3,5-dimethoxy-4-phenylmethoxyphenyl)-2-(2-pyridinyl)ethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[1-(3,5-dimethoxy-4-phenylmethoxyphenyl)-2-pyridin-2-ylethyl]piperidine-2-carboxylic acid Traditional Name: 1-[1-(4-benzoxy-3,5-dimethoxy-phenyl)-2-(2-pyridyl)ethyl]pipecolinic acid Formula: C28H32N2O5 MolecularWeight: 476.56408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(CC3=CC=CC=N3)N4CCCCC4C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(CC3=CC=CC=N3)N4CCCCC4C(=O)O

InChI

InChI=1S/C28H32N2O5/c1-33-25-16-21(17-26(34-2)27(25)35-19-20-10-4-3-5-11-20)24(18-22-12-6-8-14-29-22)30-15-9-7-13-23(30)28(31)32/h3-6,8,10-12,14,16-17,23-24H,7,9,13,15,18-19H2,1-2H3,(H,31,32)