2-[2-cyanoethyl(pyridin-3-ylmethyl)amino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-cyanoethyl(pyridin-3-ylmethyl)amino]-3-methyl-butanoic acid Openeye Name: 2-[2-cyanoethyl(3-pyridylmethyl)amino]-3-methyl-butanoic acid CAS Name: 2-[2-cyanoethyl(3-pyridinylmethyl)amino]-3-methylbutanoic acid IUPAC Name: 2-[2-cyanoethyl(pyridin-3-ylmethyl)amino]-3-methylbutanoic acid Traditional Name: 2-[2-cyanoethyl(3-pyridylmethyl)amino]-3-methyl-butyric acid Formula: C14H19N3O2 MolecularWeight: 261.31956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N(CCC#N)CC1=CN=CC=C1

Isomeric SMILES

CC(C)C(C(=O)O)N(CCC#N)CC1=CN=CC=C1

InChI

InChI=1S/C14H19N3O2/c1-11(2)13(14(18)19)17(8-4-6-15)10-12-5-3-7-16-9-12/h3,5,7,9,11,13H,4,8,10H2,1-2H3,(H,18,19)