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

Systemtic Name: 1-[(5-ethylpyridin-2-yl)-(5-methylpyridin-2-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-ethyl-2-pyridyl)-(5-methyl-2-pyridyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-ethyl-2-pyridinyl)-(5-methyl-2-pyridinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-ethylpyridin-2-yl)-(5-methylpyridin-2-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-ethyl-2-pyridyl)-(5-methyl-2-pyridyl)methyl]pipecolinic acid Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C(C2=NC=C(C=C2)C)N3CCCCC3C(=O)O

Isomeric SMILES

CCC1=CN=C(C=C1)C(C2=NC=C(C=C2)C)N3CCCCC3C(=O)O

InChI

InChI=1S/C20H25N3O2/c1-3-15-8-10-17(22-13-15)19(16-9-7-14(2)12-21-16)23-11-5-4-6-18(23)20(24)25/h7-10,12-13,18-19H,3-6,11H2,1-2H3,(H,24,25)