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

Systemtic Name: 7-[3-[(4-bromophenyl)carbamoylamino]-4-oxidanylidene-pyridin-1-yl]-3-ethoxy-6-nitro-quinoxaline-2-carboxylic acid Openeye Name: 7-[3-[(4-bromophenyl)carbamoylamino]-4-oxo-1-pyridyl]-3-ethoxy-6-nitro-quinoxaline-2-carboxylic acid CAS Name: 7-[3-[[(4-bromoanilino)-oxomethyl]amino]-4-oxo-1-pyridinyl]-3-ethoxy-6-nitro-2-quinoxalinecarboxylic acid IUPAC Name: 7-[3-[(4-bromophenyl)carbamoylamino]-4-oxopyridin-1-yl]-3-ethoxy-6-nitroquinoxaline-2-carboxylic acid Traditional Name: 7-[3-[(4-bromophenyl)carbamoylamino]-4-keto-1-pyridyl]-3-ethoxy-6-nitro-quinoxaline-2-carboxylic acid Formula: C23H17BrN6O7 MolecularWeight: 569.32108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=CC(=C(C=C2N=C1C(=O)O)N3C=CC(=O)C(=C3)NC(=O)NC4=CC=C(C=C4)Br)[N+](=O)[O-]

Isomeric SMILES

CCOC1=NC2=CC(=C(C=C2N=C1C(=O)O)N3C=CC(=O)C(=C3)NC(=O)NC4=CC=C(C=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C23H17BrN6O7/c1-2-37-21-20(22(32)33)26-14-9-17(18(30(35)36)10-15(14)27-21)29-8-7-19(31)16(11-29)28-23(34)25-13-5-3-12(24)4-6-13/h3-11H,2H2,1H3,(H,32,33)(H2,25,28,34)