ethyl 2-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 2-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methyl]pyrazole-3-carboxylate Openeye Name: ethyl 2-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]pyrazole-3-carboxylate CAS Name: 2-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]pyrazole-3-carboxylate Traditional Name: 2-[(2,3-diketo-7-nitro-1,4-dihydroquinoxalin-5-yl)methyl]pyrazole-3-carboxylic acid ethyl ester Formula: C15H13N5O6 MolecularWeight: 359.29362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=NN1CC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=NN1CC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N5O6/c1-2-26-15(23)11-3-4-16-19(11)7-8-5-9(20(24)25)6-10-12(8)18-14(22)13(21)17-10/h3-6H,2,7H2,1H3,(H,17,21)(H,18,22)