1-[(5-methylpyridin-2-yl)-pyridin-4-yl-methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(5-methylpyridin-2-yl)-pyridin-4-yl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(5-methyl-2-pyridyl)-(4-pyridyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(5-methyl-2-pyridinyl)-pyridin-4-ylmethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(5-methylpyridin-2-yl)-pyridin-4-ylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[(5-methyl-2-pyridyl)-(4-pyridyl)methyl]nipecotic acid Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C(C2=CC=NC=C2)N3CCCC(C3)C(=O)O

Isomeric SMILES

CC1=CN=C(C=C1)C(C2=CC=NC=C2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C18H21N3O2/c1-13-4-5-16(20-11-13)17(14-6-8-19-9-7-14)21-10-2-3-15(12-21)18(22)23/h4-9,11,15,17H,2-3,10,12H2,1H3,(H,22,23)