1-[1-(3-phenylmethoxyphenyl)ethyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[1-(3-phenylmethoxyphenyl)ethyl]piperidine-2-carboxylic acid Openeye Name: 1-[1-(3-benzyloxyphenyl)ethyl]piperidine-2-carboxylic acid CAS Name: 1-[1-(3-phenylmethoxyphenyl)ethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[1-(3-phenylmethoxyphenyl)ethyl]piperidine-2-carboxylic acid Traditional Name: 1-[1-(3-benzoxyphenyl)ethyl]pipecolinic acid Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)OCC2=CC=CC=C2)N3CCCCC3C(=O)O

Isomeric SMILES

CC(C1=CC(=CC=C1)OCC2=CC=CC=C2)N3CCCCC3C(=O)O

InChI

InChI=1S/C21H25NO3/c1-16(22-13-6-5-12-20(22)21(23)24)18-10-7-11-19(14-18)25-15-17-8-3-2-4-9-17/h2-4,7-11,14,16,20H,5-6,12-13,15H2,1H3,(H,23,24)