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

Systemtic Name: (2S)-2-[3-[methyl(2-pyridin-4-ylethyl)amino]propanoylamino]propanoic acid Openeye Name: (2S)-2-[3-[methyl-[2-(4-pyridyl)ethyl]amino]propanoylamino]propanoic acid CAS Name: (2S)-2-[[3-[methyl(2-pyridin-4-ylethyl)amino]-1-oxopropyl]amino]propanoic acid IUPAC Name: (2S)-2-[3-[methyl(2-pyridin-4-ylethyl)amino]propanoylamino]propanoic acid Traditional Name: (2S)-2-[3-[methyl-[2-(4-pyridyl)ethyl]amino]propanoylamino]propionic acid Formula: C14H21N3O3 MolecularWeight: 279.33484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O3/c1-11(14(19)20)16-13(18)6-10-17(2)9-5-12-3-7-15-8-4-12/h3-4,7-8,11H,5-6,9-10H2,1-2H3,(H,16,18)(H,19,20)/t11-/m0/s1