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

Systemtic Name: [2-[3-methyl-4-(4-nitrophenoxy)phenyl]-2-oxidanylidene-ethyl] 6-chloranyl-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-[3-methyl-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-[3-methyl-4-(4-nitrophenoxy)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[3-methyl-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-[3-methyl-4-(4-nitrophenoxy)phenyl]ethyl] ester Formula: C33H25ClN2O6 MolecularWeight: 581.0144

Click to see the large picture

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)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)C

InChI

InChI=1S/C33H25ClN2O6/c1-19-4-6-22(7-5-19)32-21(3)31(27-17-24(34)9-14-28(27)35-32)33(38)41-18-29(37)23-8-15-30(20(2)16-23)42-26-12-10-25(11-13-26)36(39)40/h4-17H,18H2,1-3H3