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

Systemtic Name: 4-azanyl-5-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]-5-oxo-pentanoic acid CAS Name: 4-amino-5-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]-5-oxopentanoic acid IUPAC Name: 4-amino-5-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]-5-oxopentanoic acid Traditional Name: 4-amino-5-[(2,3-diketo-7-nitro-1,4-dihydroquinoxalin-5-yl)methylamino]-5-keto-valeric acid Formula: C14H15N5O7 MolecularWeight: 365.2982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N5O7/c15-8(1-2-10(20)21)12(22)16-5-6-3-7(19(25)26)4-9-11(6)18-14(24)13(23)17-9/h3-4,8H,1-2,5,15H2,(H,16,22)(H,17,23)(H,18,24)(H,20,21)