7-[4-[2-[(4-carboxyphenyl)carbamoyloxy]ethyl]imidazol-1-yl]-6-nitro-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid

Systemtic Name: 7-[4-[2-[(4-carboxyphenyl)carbamoyloxy]ethyl]imidazol-1-yl]-6-nitro-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid Openeye Name: 7-[4-[2-[(4-carboxyphenyl)carbamoyloxy]ethyl]imidazol-1-yl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid CAS Name: 7-[4-[2-[(4-carboxyanilino)-oxomethoxy]ethyl]-1-imidazolyl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid IUPAC Name: 7-[4-[2-[(4-carboxyphenyl)carbamoyloxy]ethyl]imidazol-1-yl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid Traditional Name: 7-[4-[2-[(4-carboxyphenyl)carbamoyloxy]ethyl]imidazol-1-yl]-3-keto-6-nitro-4H-quinoxaline-2-carboxylic acid Formula: C22H16N6O9 MolecularWeight: 508.39724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)OCCC2=CN(C=N2)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)OCCC2=CN(C=N2)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C22H16N6O9/c29-19-18(21(32)33)25-14-7-16(17(28(35)36)8-15(14)26-19)27-9-13(23-10-27)5-6-37-22(34)24-12-3-1-11(2-4-12)20(30)31/h1-4,7-10H,5-6H2,(H,24,34)(H,26,29)(H,30,31)(H,32,33)