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

Systemtic Name: ethyl 7-[3-[(4-bromophenyl)carbamoylamino]-4-oxidanylidene-pyridin-1-yl]-3-ethoxy-6-nitro-quinoxaline-2-carboxylate Openeye Name: ethyl 7-[3-[(4-bromophenyl)carbamoylamino]-4-oxo-1-pyridyl]-3-ethoxy-6-nitro-quinoxaline-2-carboxylate CAS Name: 7-[3-[[(4-bromoanilino)-oxomethyl]amino]-4-oxo-1-pyridinyl]-3-ethoxy-6-nitro-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[3-[(4-bromophenyl)carbamoylamino]-4-oxopyridin-1-yl]-3-ethoxy-6-nitroquinoxaline-2-carboxylate Traditional Name: 7-[3-[(4-bromophenyl)carbamoylamino]-4-keto-1-pyridyl]-3-ethoxy-6-nitro-quinoxaline-2-carboxylic acid ethyl ester Formula: C25H21BrN6O7 MolecularWeight: 597.37424

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C25H21BrN6O7/c1-3-38-23-22(24(34)39-4-2)28-16-11-19(20(32(36)37)12-17(16)29-23)31-10-9-21(33)18(13-31)30-25(35)27-15-7-5-14(26)6-8-15/h5-13H,3-4H2,1-2H3,(H2,27,30,35)