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

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

Systemtic Name:2-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methylamino]pentanedioic acid
Openeye Name:2-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]pentanedioic acid
CAS Name:2-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]pentanedioic acid
IUPAC Name:2-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]pentanedioic acid
Traditional Name:2-[(2,3-diketo-7-nitro-1,4-dihydroquinoxalin-5-yl)methylamino]glutaric acid
Formula: C14H14N4O8
MolecularWeight: 366.28296
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C14H14N4O8/c19-10(20)2-1-8(14(23)24)15-5-6-3-7(18(25)26)4-9-11(6)17-13(22)12(21)16-9/h3-4,8,15H,1-2,5H2,(H,16,21)(H,17,22)(H,19,20)(H,23,24)


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