[2-[4-(4-nitrophenoxy)phenyl]-2-oxidanylidene-ethyl] 6-chloranyl-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-[4-(4-nitrophenoxy)phenyl]-2-oxidanylidene-ethyl] 6-chloranyl-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-[4-(4-nitrophenoxy)phenyl]-2-oxo-ethyl] 6-chloro-3-methyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 6-chloro-3-methyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl] 6-chloro-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 6-chloro-3-methyl-2-(p-tolyl)cinchoninic acid [2-keto-2-[4-(4-nitrophenoxy)phenyl]ethyl] ester Formula: C32H23ClN2O6 MolecularWeight: 566.98782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)Cl)C(=O)OCC(=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)Cl)C(=O)OCC(=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)[N+](=O)[O-])C

InChI

InChI=1S/C32H23ClN2O6/c1-19-3-5-22(6-4-19)31-20(2)30(27-17-23(33)9-16-28(27)34-31)32(37)40-18-29(36)21-7-12-25(13-8-21)41-26-14-10-24(11-15-26)35(38)39/h3-17H,18H2,1-2H3