1-[(5-methylpyridin-2-yl)-(4-phenylmethoxyphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(5-methylpyridin-2-yl)-(4-phenylmethoxyphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxyphenyl)-(5-methyl-2-pyridyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-methyl-2-pyridinyl)-(4-phenylmethoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-methylpyridin-2-yl)-(4-phenylmethoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxyphenyl)-(5-methyl-2-pyridyl)methyl]pipecolinic acid Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)N4CCCCC4C(=O)O

Isomeric SMILES

CC1=CN=C(C=C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)N4CCCCC4C(=O)O

InChI

InChI=1S/C26H28N2O3/c1-19-10-15-23(27-17-19)25(28-16-6-5-9-24(28)26(29)30)21-11-13-22(14-12-21)31-18-20-7-3-2-4-8-20/h2-4,7-8,10-15,17,24-25H,5-6,9,16,18H2,1H3,(H,29,30)