methyl (2S)-4-methyl-2-[(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)carbonylamino]pentanoate

Systemtic Name: methyl (2S)-4-methyl-2-[(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)carbonylamino]pentanoate Openeye Name: methyl (2S)-4-methyl-2-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]pentanoate CAS Name: (2S)-4-methyl-2-[[oxo-(3-oxo-2,4-dihydroquinoxalin-1-yl)methyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S)-4-methyl-2-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]pentanoate Traditional Name: (2S)-2-[(3-keto-2,4-dihydroquinoxaline-1-carbonyl)amino]-4-methyl-valeric acid methyl ester Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)N1CC(=O)NC2=CC=CC=C21

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O4/c1-10(2)8-12(15(21)23-3)18-16(22)19-9-14(20)17-11-6-4-5-7-13(11)19/h4-7,10,12H,8-9H2,1-3H3,(H,17,20)(H,18,22)/t12-/m0/s1