[2-[3-methyl-4-(4-nitrophenoxy)phenyl]-2-oxidanylidene-ethyl] 7-chloranyl-3,8-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-[3-methyl-4-(4-nitrophenoxy)phenyl]-2-oxidanylidene-ethyl] 7-chloranyl-3,8-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[3-methyl-4-(4-nitrophenoxy)phenyl]-2-oxo-ethyl] 7-chloro-3,8-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 7-chloro-3,8-dimethyl-2-phenyl-4-quinolinecarboxylic acid [2-[3-methyl-4-(4-nitrophenoxy)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[3-methyl-4-(4-nitrophenoxy)phenyl]-2-oxoethyl] 7-chloro-3,8-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 7-chloro-3,8-dimethyl-2-phenyl-cinchoninic acid [2-keto-2-[3-methyl-4-(4-nitrophenoxy)phenyl]ethyl] ester Formula: C33H25ClN2O6 MolecularWeight: 581.0144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)COC(=O)C2=C3C=CC(=C(C3=NC(=C2C)C4=CC=CC=C4)C)Cl)OC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)COC(=O)C2=C3C=CC(=C(C3=NC(=C2C)C4=CC=CC=C4)C)Cl)OC5=CC=C(C=C5)[N+](=O)[O-]

InChI

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