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

Systemtic Name: 7-[3-[(3-bromophenyl)carbamoyloxymethyl]-4-oxidanylidene-pyridin-1-yl]-6-nitro-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid Openeye Name: 7-[3-[(3-bromophenyl)carbamoyloxymethyl]-4-oxo-1-pyridyl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid CAS Name: 7-[3-[[(3-bromoanilino)-oxomethoxy]methyl]-4-oxo-1-pyridinyl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid IUPAC Name: 7-[3-[(3-bromophenyl)carbamoyloxymethyl]-4-oxopyridin-1-yl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid Traditional Name: 7-[3-[(3-bromophenyl)carbamoyloxymethyl]-4-keto-1-pyridyl]-3-keto-6-nitro-4H-quinoxaline-2-carboxylic acid Formula: C22H14BrN5O8 MolecularWeight: 556.27926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC(=O)OCC2=CN(C=CC2=O)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC(=O)OCC2=CN(C=CC2=O)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C22H14BrN5O8/c23-12-2-1-3-13(6-12)24-22(33)36-10-11-9-27(5-4-18(11)29)16-7-14-15(8-17(16)28(34)35)26-20(30)19(25-14)21(31)32/h1-9H,10H2,(H,24,33)(H,26,30)(H,31,32)