(2S)-2-azanyl-3-[6,7-dimethyl-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[6,7-dimethyl-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]propanoic acid Openeye Name: (2S)-2-amino-3-(6,7-dimethyl-2,3-dioxo-4H-quinoxalin-1-yl)propanoic acid CAS Name: (2S)-2-amino-3-(6,7-dimethyl-2,3-dioxo-4H-quinoxalin-1-yl)propanoic acid IUPAC Name: (2S)-2-amino-3-(6,7-dimethyl-2,3-dioxo-4H-quinoxalin-1-yl)propanoic acid Traditional Name: (2S)-2-amino-3-(2,3-diketo-6,7-dimethyl-4H-quinoxalin-1-yl)propionic acid Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=O)C(=O)N2)CC(C(=O)O)N

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=O)C(=O)N2)C[C@@H](C(=O)O)N

InChI

InChI=1S/C13H15N3O4/c1-6-3-9-10(4-7(6)2)16(5-8(14)13(19)20)12(18)11(17)15-9/h3-4,8H,5,14H2,1-2H3,(H,15,17)(H,19,20)/t8-/m0/s1