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

Systemtic Name: 1-[1-(3,5-dimethoxy-4-phenylmethoxy-phenyl)propyl]piperidine-3-carboxylic acid Openeye Name: 1-[1-(4-benzyloxy-3,5-dimethoxy-phenyl)propyl]piperidine-3-carboxylic acid CAS Name: 1-[1-(3,5-dimethoxy-4-phenylmethoxyphenyl)propyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[1-(3,5-dimethoxy-4-phenylmethoxyphenyl)propyl]piperidine-3-carboxylic acid Traditional Name: 1-[1-(4-benzoxy-3,5-dimethoxy-phenyl)propyl]nipecotic acid Formula: C24H31NO5 MolecularWeight: 413.50664

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C(=C1)OC)OCC2=CC=CC=C2)OC)N3CCCC(C3)C(=O)O

Isomeric SMILES

CCC(C1=CC(=C(C(=C1)OC)OCC2=CC=CC=C2)OC)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C24H31NO5/c1-4-20(25-12-8-11-18(15-25)24(26)27)19-13-21(28-2)23(22(14-19)29-3)30-16-17-9-6-5-7-10-17/h5-7,9-10,13-14,18,20H,4,8,11-12,15-16H2,1-3H3,(H,26,27)