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

Systemtic Name: 1-[1-(3,5-dimethoxy-4-phenylmethoxy-phenyl)ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(4-benzyloxy-3,5-dimethoxy-phenyl)ethyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(3,5-dimethoxy-4-phenylmethoxyphenyl)ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-(3,5-dimethoxy-4-phenylmethoxyphenyl)ethyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(4-benzoxy-3,5-dimethoxy-phenyl)ethyl]isonipecotic acid Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO5/c1-16(24-11-9-18(10-12-24)23(25)26)19-13-20(27-2)22(21(14-19)28-3)29-15-17-7-5-4-6-8-17/h4-8,13-14,16,18H,9-12,15H2,1-3H3,(H,25,26)