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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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