3-azanyl-3-[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]propanoic acid

Systemtic Name: 3-azanyl-3-[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]propanoic acid Openeye Name: 3-amino-3-(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)propanoic acid CAS Name: 3-amino-3-(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)propanoic acid IUPAC Name: 3-amino-3-(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)propanoic acid Traditional Name: 3-amino-3-(2,3-diketo-7-nitro-1,4-dihydroquinoxalin-5-yl)propionic acid Formula: C11H10N4O6 MolecularWeight: 294.2203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=C1NC(=O)C(=O)N2)C(CC(=O)O)N)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C2=C1NC(=O)C(=O)N2)C(CC(=O)O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H10N4O6/c12-6(3-8(16)17)5-1-4(15(20)21)2-7-9(5)14-11(19)10(18)13-7/h1-2,6H,3,12H2,(H,13,18)(H,14,19)(H,16,17)