1-[1-(4-phenylmethoxyphenyl)ethyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[1-(4-phenylmethoxyphenyl)ethyl]piperidine-2-carboxylic acid Openeye Name: 1-[1-(4-benzyloxyphenyl)ethyl]piperidine-2-carboxylic acid CAS Name: 1-[1-(4-phenylmethoxyphenyl)ethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[1-(4-phenylmethoxyphenyl)ethyl]piperidine-2-carboxylic acid Traditional Name: 1-[1-(4-benzoxyphenyl)ethyl]pipecolinic acid Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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