8-[(methoxycarbonylamino)methyl]-6-nitro-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-2-carboxylic acid

Systemtic Name: 8-[(methoxycarbonylamino)methyl]-6-nitro-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-2-carboxylic acid Openeye Name: 8-[(methoxycarbonylamino)methyl]-6-nitro-3-oxo-2,4-dihydro-1H-quinoxaline-2-carboxylic acid CAS Name: 8-[(methoxycarbonylamino)methyl]-6-nitro-3-oxo-2,4-dihydro-1H-quinoxaline-2-carboxylic acid IUPAC Name: 8-[(methoxycarbonylamino)methyl]-6-nitro-3-oxo-2,4-dihydro-1H-quinoxaline-2-carboxylic acid Traditional Name: 8-[(carbomethoxyamino)methyl]-3-keto-6-nitro-2,4-dihydro-1H-quinoxaline-2-carboxylic acid Formula: C12H12N4O7 MolecularWeight: 324.24628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NCC1=CC(=CC2=C1NC(C(=O)N2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)NCC1=CC(=CC2=C1NC(C(=O)N2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O7/c1-23-12(20)13-4-5-2-6(16(21)22)3-7-8(5)15-9(11(18)19)10(17)14-7/h2-3,9,15H,4H2,1H3,(H,13,20)(H,14,17)(H,18,19)