[2-[3-methyl-4-(4-nitrophenoxy)phenyl]-2-oxidanylidene-ethyl] 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-[3-methyl-4-(4-nitrophenoxy)phenyl]-2-oxidanylidene-ethyl] 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[3-methyl-4-(4-nitrophenoxy)phenyl]-2-oxo-ethyl] 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6,8-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] 6,8-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 6,8-dimethyl-2-phenyl-cinchoninic acid [2-keto-2-[3-methyl-4-(4-nitrophenoxy)phenyl]ethyl] ester Formula: C33H26N2O6 MolecularWeight: 546.56934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC(=O)C4=CC(=C(C=C4)OC5=CC=C(C=C5)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC(=O)C4=CC(=C(C=C4)OC5=CC=C(C=C5)[N+](=O)[O-])C)C

InChI

InChI=1S/C33H26N2O6/c1-20-15-22(3)32-27(16-20)28(18-29(34-32)23-7-5-4-6-8-23)33(37)40-19-30(36)24-9-14-31(21(2)17-24)41-26-12-10-25(11-13-26)35(38)39/h4-18H,19H2,1-3H3