1-[4-(carboxymethyl)-7-nitro-2,3-bis(oxidanylidene)-1H-quinoxalin-6-yl]pyrrole-3-carboxylic acid

Systemtic Name: 1-[4-(carboxymethyl)-7-nitro-2,3-bis(oxidanylidene)-1H-quinoxalin-6-yl]pyrrole-3-carboxylic acid Openeye Name: 1-[4-(carboxymethyl)-7-nitro-2,3-dioxo-1H-quinoxalin-6-yl]pyrrole-3-carboxylic acid CAS Name: 1-[4-(carboxymethyl)-7-nitro-2,3-dioxo-1H-quinoxalin-6-yl]-3-pyrrolecarboxylic acid IUPAC Name: 1-[4-(carboxymethyl)-7-nitro-2,3-dioxo-1H-quinoxalin-6-yl]pyrrole-3-carboxylic acid Traditional Name: 1-[4-(carboxymethyl)-2,3-diketo-7-nitro-1H-quinoxalin-6-yl]pyrrole-3-carboxylic acid Formula: C15H10N4O8 MolecularWeight: 374.2619

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1C(=O)O)C2=C(C=C3C(=C2)N(C(=O)C(=O)N3)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CN(C=C1C(=O)O)C2=C(C=C3C(=C2)N(C(=O)C(=O)N3)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H10N4O8/c20-12(21)6-18-9-4-10(17-2-1-7(5-17)15(24)25)11(19(26)27)3-8(9)16-13(22)14(18)23/h1-5H,6H2,(H,16,22)(H,20,21)(H,24,25)