[1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 2-oxidanylidene-1H-quinoline-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 2-oxidanylidene-1H-quinoline-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 2-oxo-1H-quinoline-4-carboxylate CAS Name: 2-oxo-1H-quinoline-4-carboxylic acid [1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] 2-oxo-1H-quinoline-4-carboxylate Traditional Name: 2-keto-1H-quinoline-4-carboxylic acid [2-keto-1-methyl-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C22H21NO4 MolecularWeight: 363.40644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)C(C)OC(=O)C2=CC(=O)NC3=CC=CC=C32)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)C(C)OC(=O)C2=CC(=O)NC3=CC=CC=C32)C)C

InChI

InChI=1S/C22H21NO4/c1-12-9-14(3)17(10-13(12)2)21(25)15(4)27-22(26)18-11-20(24)23-19-8-6-5-7-16(18)19/h5-11,15H,1-4H3,(H,23,24)