(2S)-3-methyl-2-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)butanoate

Systemtic Name: (2S)-3-methyl-2-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)butanoate Openeye Name: (2S)-3-methyl-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanoate CAS Name: (2S)-3-methyl-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanoate IUPAC Name: (2S)-3-methyl-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanoate Traditional Name: (2S)-2-(3-keto-2,4-dihydroquinoxalin-1-yl)-3-methyl-butyrate Formula: C13H15N2O3- MolecularWeight: 247.2698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])N1CC(=O)NC2=CC=CC=C21

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])N1CC(=O)NC2=CC=CC=C21

InChI

InChI=1S/C13H16N2O3/c1-8(2)12(13(17)18)15-7-11(16)14-9-5-3-4-6-10(9)15/h3-6,8,12H,7H2,1-2H3,(H,14,16)(H,17,18)/p-1/t12-/m0/s1