1-[(3,4-dimethoxyphenyl)-(3-methylpyridin-4-yl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3,4-dimethoxyphenyl)-(3-methylpyridin-4-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3,4-dimethoxyphenyl)-(3-methyl-4-pyridyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,4-dimethoxyphenyl)-(3-methyl-4-pyridinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,4-dimethoxyphenyl)-(3-methylpyridin-4-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3,4-dimethoxyphenyl)-(3-methyl-4-pyridyl)methyl]pipecolinic acid Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)C(C2=CC(=C(C=C2)OC)OC)N3CCCCC3C(=O)O

Isomeric SMILES

CC1=C(C=CN=C1)C(C2=CC(=C(C=C2)OC)OC)N3CCCCC3C(=O)O

InChI

InChI=1S/C21H26N2O4/c1-14-13-22-10-9-16(14)20(23-11-5-4-6-17(23)21(24)25)15-7-8-18(26-2)19(12-15)27-3/h7-10,12-13,17,20H,4-6,11H2,1-3H3,(H,24,25)