1-[1-(3-phenoxyphenyl)ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[1-(3-phenoxyphenyl)ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[1-(3-phenoxyphenyl)ethyl]piperidine-3-carboxylic acid CAS Name: 1-[1-(3-phenoxyphenyl)ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[1-(3-phenoxyphenyl)ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[1-(3-phenoxyphenyl)ethyl]nipecotic acid Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)OC2=CC=CC=C2)N3CCCC(C3)C(=O)O

Isomeric SMILES

CC(C1=CC(=CC=C1)OC2=CC=CC=C2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C20H23NO3/c1-15(21-12-6-8-17(14-21)20(22)23)16-7-5-11-19(13-16)24-18-9-3-2-4-10-18/h2-5,7,9-11,13,15,17H,6,8,12,14H2,1H3,(H,22,23)