1-[1-(3,4-diethoxyphenyl)-2-pyridin-2-yl-ethyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[1-(3,4-diethoxyphenyl)-2-pyridin-2-yl-ethyl]piperidine-2-carboxylic acid Openeye Name: 1-[1-(3,4-diethoxyphenyl)-2-(2-pyridyl)ethyl]piperidine-2-carboxylic acid CAS Name: 1-[1-(3,4-diethoxyphenyl)-2-(2-pyridinyl)ethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[1-(3,4-diethoxyphenyl)-2-pyridin-2-ylethyl]piperidine-2-carboxylic acid Traditional Name: 1-[1-(3,4-diethoxyphenyl)-2-(2-pyridyl)ethyl]pipecolinic acid Formula: C23H30N2O4 MolecularWeight: 398.4953

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CC2=CC=CC=N2)N3CCCCC3C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(CC2=CC=CC=N2)N3CCCCC3C(=O)O)OCC

InChI

InChI=1S/C23H30N2O4/c1-3-28-21-12-11-17(15-22(21)29-4-2)20(16-18-9-5-7-13-24-18)25-14-8-6-10-19(25)23(26)27/h5,7,9,11-13,15,19-20H,3-4,6,8,10,14,16H2,1-2H3,(H,26,27)