[2-(4-methoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2-(4-bromophenyl)-6-methyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-methoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2-(4-bromophenyl)-6-methyl-quinoline-4-carboxylate Openeye Name: [2-(4-methoxy-3-nitro-phenyl)-2-oxo-ethyl] 2-(4-bromophenyl)-6-methyl-quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-6-methyl-4-quinolinecarboxylic acid [2-(4-methoxy-3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxy-3-nitrophenyl)-2-oxoethyl] 2-(4-bromophenyl)-6-methylquinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)-6-methyl-cinchoninic acid [2-keto-2-(4-methoxy-3-nitro-phenyl)ethyl] ester Formula: C26H19BrN2O6 MolecularWeight: 535.34286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H19BrN2O6/c1-15-3-9-21-19(11-15)20(13-22(28-21)16-4-7-18(27)8-5-16)26(31)35-14-24(30)17-6-10-25(34-2)23(12-17)29(32)33/h3-13H,14H2,1-2H3