methyl 2-(6-nitro-3-oxidanylidene-4H-quinoxalin-2-yl)-4-[(3-nitrophenyl)amino]-3,4-bis(oxidanylidene)butanoate

Systemtic Name: methyl 2-(6-nitro-3-oxidanylidene-4H-quinoxalin-2-yl)-4-[(3-nitrophenyl)amino]-3,4-bis(oxidanylidene)butanoate Openeye Name: methyl 4-(3-nitroanilino)-2-(6-nitro-3-oxo-4H-quinoxalin-2-yl)-3,4-dioxo-butanoate CAS Name: 4-(3-nitroanilino)-2-(6-nitro-3-oxo-4H-quinoxalin-2-yl)-3,4-dioxobutanoic acid methyl ester IUPAC Name: methyl 4-(3-nitroanilino)-2-(6-nitro-3-oxo-4H-quinoxalin-2-yl)-3,4-dioxobutanoate Traditional Name: 3,4-diketo-2-(3-keto-6-nitro-4H-quinoxalin-2-yl)-4-(3-nitroanilino)butyric acid methyl ester Formula: C19H13N5O9 MolecularWeight: 455.33462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=NC2=C(C=C(C=C2)[N+](=O)[O-])NC1=O)C(=O)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(C1=NC2=C(C=C(C=C2)[N+](=O)[O-])NC1=O)C(=O)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H13N5O9/c1-33-19(28)14(16(25)18(27)20-9-3-2-4-10(7-9)23(29)30)15-17(26)22-13-8-11(24(31)32)5-6-12(13)21-15/h2-8,14H,1H3,(H,20,27)(H,22,26)