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

Systemtic Name: 1-[(4-dimethylaminophenyl)-(2-phenylmethoxyphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2-benzyloxyphenyl)-(4-dimethylaminophenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(4-dimethylaminophenyl)-(2-phenylmethoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-dimethylaminophenyl)-(2-phenylmethoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2-benzoxyphenyl)-(4-dimethylaminophenyl)methyl]pipecolinic acid Formula: C28H32N2O3 MolecularWeight: 444.56528

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C2=CC=CC=C2OCC3=CC=CC=C3)N4CCCCC4C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(C2=CC=CC=C2OCC3=CC=CC=C3)N4CCCCC4C(=O)O

InChI

InChI=1S/C28H32N2O3/c1-29(2)23-17-15-22(16-18-23)27(30-19-9-8-13-25(30)28(31)32)24-12-6-7-14-26(24)33-20-21-10-4-3-5-11-21/h3-7,10-12,14-18,25,27H,8-9,13,19-20H2,1-2H3,(H,31,32)