(1-oxidanylidene-1-phenyl-propan-2-yl) 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 3,6,8-trimethyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 3,6,8-trimethyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 3,6,8-trimethyl-2-(p-tolyl)cinchoninic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C29H27NO3 MolecularWeight: 437.52958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2C)C(=O)OC(C)C(=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2C)C(=O)OC(C)C(=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C29H27NO3/c1-17-11-13-22(14-12-17)27-20(4)25(24-16-18(2)15-19(3)26(24)30-27)29(32)33-21(5)28(31)23-9-7-6-8-10-23/h6-16,21H,1-5H3