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

Systemtic Name: 7-[3-[2-(4-bromophenyl)ethanoylamino]-4-oxidanylidene-pyridin-1-yl]-6-nitro-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid Openeye Name: 7-[3-[[2-(4-bromophenyl)acetyl]amino]-4-oxo-1-pyridyl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid CAS Name: 7-[3-[[2-(4-bromophenyl)-1-oxoethyl]amino]-4-oxo-1-pyridinyl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid IUPAC Name: 7-[3-[[2-(4-bromophenyl)acetyl]amino]-4-oxopyridin-1-yl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid Traditional Name: 7-[3-[[2-(4-bromophenyl)acetyl]amino]-4-keto-1-pyridyl]-3-keto-6-nitro-4H-quinoxaline-2-carboxylic acid Formula: C22H14BrN5O7 MolecularWeight: 540.27986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NC2=CN(C=CC2=O)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)O)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1CC(=O)NC2=CN(C=CC2=O)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)O)[N+](=O)[O-])Br

InChI

InChI=1S/C22H14BrN5O7/c23-12-3-1-11(2-4-12)7-19(30)24-15-10-27(6-5-18(15)29)16-8-13-14(9-17(16)28(34)35)26-21(31)20(25-13)22(32)33/h1-6,8-10H,7H2,(H,24,30)(H,26,31)(H,32,33)