1-[2-[[2-(phenylmethyl)phenyl]methoxy]ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-[[2-(phenylmethyl)phenyl]methoxy]ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-[(2-benzylphenyl)methoxy]ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-[[2-(phenylmethyl)phenyl]methoxy]ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-[(2-benzylphenyl)methoxy]ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(2-benzylbenzyl)oxyethyl]nipecotic acid Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCOCC2=CC=CC=C2CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CCOCC2=CC=CC=C2CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H27NO3/c24-22(25)20-11-6-12-23(16-20)13-14-26-17-21-10-5-4-9-19(21)15-18-7-2-1-3-8-18/h1-5,7-10,20H,6,11-17H2,(H,24,25)