(2S)-3-methyl-2-[methyl(2-pyridin-4-ylethyl)amino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[methyl(2-pyridin-4-ylethyl)amino]butanoic acid Openeye Name: (2S)-3-methyl-2-[methyl-[2-(4-pyridyl)ethyl]amino]butanoic acid CAS Name: (2S)-3-methyl-2-[methyl(2-pyridin-4-ylethyl)amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[methyl(2-pyridin-4-ylethyl)amino]butanoic acid Traditional Name: (2S)-3-methyl-2-[methyl-[2-(4-pyridyl)ethyl]amino]butyric acid Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N(C)CCC1=CC=NC=C1

Isomeric SMILES

CC(C)[C@@H](C(=O)O)N(C)CCC1=CC=NC=C1

InChI

InChI=1S/C13H20N2O2/c1-10(2)12(13(16)17)15(3)9-6-11-4-7-14-8-5-11/h4-5,7-8,10,12H,6,9H2,1-3H3,(H,16,17)/t12-/m0/s1