ethyl 2-(chloromethyl)-6,7-dimethoxy-4-(4-methylphenyl)quinoline-3-carboxylate

Systemtic Name: ethyl 2-(chloromethyl)-6,7-dimethoxy-4-(4-methylphenyl)quinoline-3-carboxylate Openeye Name: ethyl 2-(chloromethyl)-6,7-dimethoxy-4-(p-tolyl)quinoline-3-carboxylate CAS Name: 2-(chloromethyl)-6,7-dimethoxy-4-(4-methylphenyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(chloromethyl)-6,7-dimethoxy-4-(4-methylphenyl)quinoline-3-carboxylate Traditional Name: 2-(chloromethyl)-6,7-dimethoxy-4-(p-tolyl)quinoline-3-carboxylic acid ethyl ester Formula: C22H22ClNO4 MolecularWeight: 399.86738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CCl)OC)OC)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CCl)OC)OC)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H22ClNO4/c1-5-28-22(25)21-17(12-23)24-16-11-19(27-4)18(26-3)10-15(16)20(21)14-8-6-13(2)7-9-14/h6-11H,5,12H2,1-4H3