[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl] 2-methylquinoline-4-carboxylate

Systemtic Name: [2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl] 2-methylquinoline-4-carboxylate Openeye Name: [2-(5-chloro-2,4-dimethoxy-anilino)-2-oxo-ethyl] 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl] 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [2-(5-chloro-2,4-dimethoxy-anilino)-2-keto-ethyl] ester Formula: C21H19ClN2O5 MolecularWeight: 414.83896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)NC3=CC(=C(C=C3OC)OC)Cl

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)NC3=CC(=C(C=C3OC)OC)Cl

InChI

InChI=1S/C21H19ClN2O5/c1-12-8-14(13-6-4-5-7-16(13)23-12)21(26)29-11-20(25)24-17-9-15(22)18(27-2)10-19(17)28-3/h4-10H,11H2,1-3H3,(H,24,25)