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

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

Systemtic Name:1-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methylamino]cyclopropane-1-carboxylic acid
Openeye Name:1-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]cyclopropanecarboxylic acid
CAS Name:1-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]-1-cyclopropanecarboxylic acid
IUPAC Name:1-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]cyclopropane-1-carboxylic acid
Traditional Name:1-[(2,3-diketo-7-nitro-1,4-dihydroquinoxalin-5-yl)methylamino]cyclopropanecarboxylic acid
Formula: C13H12N4O6
MolecularWeight: 320.25758
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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C(=O)O)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-]


Isomeric SMILES

C1CC1(C(=O)O)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-]


InChI

InChI=1S/C13H12N4O6/c18-10-11(19)16-9-6(5-14-13(1-2-13)12(20)21)3-7(17(22)23)4-8(9)15-10/h3-4,14H,1-2,5H2,(H,15,18)(H,16,19)(H,20,21)


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