1-[1-(3-methoxy-4-phenylmethoxy-phenyl)ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1-(3-methoxy-4-phenylmethoxy-phenyl)ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(4-benzyloxy-3-methoxy-phenyl)ethyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(3-methoxy-4-phenylmethoxyphenyl)ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-(3-methoxy-4-phenylmethoxyphenyl)ethyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(4-benzoxy-3-methoxy-phenyl)ethyl]isonipecotic acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C22H27NO4/c1-16(23-12-10-18(11-13-23)22(24)25)19-8-9-20(21(14-19)26-2)27-15-17-6-4-3-5-7-17/h3-9,14,16,18H,10-13,15H2,1-2H3,(H,24,25)