7-[5-[(2-bromophenyl)carbamoyloxymethyl]-1H-imidazol-2-yl]-6-nitro-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid

Systemtic Name: 7-[5-[(2-bromophenyl)carbamoyloxymethyl]-1H-imidazol-2-yl]-6-nitro-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid Openeye Name: 7-[5-[(2-bromophenyl)carbamoyloxymethyl]-1H-imidazol-2-yl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid CAS Name: 7-[5-[[(2-bromoanilino)-oxomethoxy]methyl]-1H-imidazol-2-yl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid IUPAC Name: 7-[5-[(2-bromophenyl)carbamoyloxymethyl]-1H-imidazol-2-yl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid Traditional Name: 7-[5-[(2-bromophenyl)carbamoyloxymethyl]-1H-imidazol-2-yl]-3-keto-6-nitro-4H-quinoxaline-2-carboxylic acid Formula: C20H13BrN6O7 MolecularWeight: 529.25722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)OCC2=CN=C(N2)C3=CC4=C(C=C3[N+](=O)[O-])NC(=O)C(=N4)C(=O)O)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)OCC2=CN=C(N2)C3=CC4=C(C=C3[N+](=O)[O-])NC(=O)C(=N4)C(=O)O)Br

InChI

InChI=1S/C20H13BrN6O7/c21-11-3-1-2-4-12(11)26-20(31)34-8-9-7-22-17(23-9)10-5-13-14(6-15(10)27(32)33)25-18(28)16(24-13)19(29)30/h1-7H,8H2,(H,22,23)(H,25,28)(H,26,31)(H,29,30)