1-(2-ethylpyrimidin-4-yl)-4-methyl-piperidine-4-carboxylic acid

Systemtic Name: 1-(2-ethylpyrimidin-4-yl)-4-methyl-piperidine-4-carboxylic acid Openeye Name: 1-(2-ethylpyrimidin-4-yl)-4-methyl-piperidine-4-carboxylic acid CAS Name: 1-(2-ethyl-4-pyrimidinyl)-4-methyl-4-piperidinecarboxylic acid IUPAC Name: 1-(2-ethylpyrimidin-4-yl)-4-methylpiperidine-4-carboxylic acid Traditional Name: 1-(2-ethylpyrimidin-4-yl)-4-methyl-isonipecotic acid Formula: C13H19N3O2 MolecularWeight: 249.30886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CC(=N1)N2CCC(CC2)(C)C(=O)O

Isomeric SMILES

CCC1=NC=CC(=N1)N2CCC(CC2)(C)C(=O)O

InChI

InChI=1S/C13H19N3O2/c1-3-10-14-7-4-11(15-10)16-8-5-13(2,6-9-16)12(17)18/h4,7H,3,5-6,8-9H2,1-2H3,(H,17,18)