[1-(2,4-dimethoxyphenyl)-1-oxidanylidene-propan-2-yl] 2-methylquinoline-4-carboxylate

Systemtic Name: [1-(2,4-dimethoxyphenyl)-1-oxidanylidene-propan-2-yl] 2-methylquinoline-4-carboxylate Openeye Name: [2-(2,4-dimethoxyphenyl)-1-methyl-2-oxo-ethyl] 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [1-(2,4-dimethoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,4-dimethoxyphenyl)-1-oxopropan-2-yl] 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [2-(2,4-dimethoxyphenyl)-2-keto-1-methyl-ethyl] ester Formula: C22H21NO5 MolecularWeight: 379.40584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OC(C)C(=O)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OC(C)C(=O)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C22H21NO5/c1-13-11-18(16-7-5-6-8-19(16)23-13)22(25)28-14(2)21(24)17-10-9-15(26-3)12-20(17)27-4/h5-12,14H,1-4H3