(2S)-3-methyl-2-[(2-methylquinolin-4-yl)carbonylamino]butanoate

Systemtic Name: (2S)-3-methyl-2-[(2-methylquinolin-4-yl)carbonylamino]butanoate Openeye Name: (2S)-3-methyl-2-[(2-methylquinoline-4-carbonyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2-methyl-4-quinolinyl)-oxomethyl]amino]butanoate IUPAC Name: (2S)-3-methyl-2-[(2-methylquinoline-4-carbonyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-methylquinoline-4-carbonyl)amino]butyrate Formula: C16H17N2O3- MolecularWeight: 285.31778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)NC(C(C)C)C(=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)N[C@@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C16H18N2O3/c1-9(2)14(16(20)21)18-15(19)12-8-10(3)17-13-7-5-4-6-11(12)13/h4-9,14H,1-3H3,(H,18,19)(H,20,21)/p-1/t14-/m0/s1