[2-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)-2-oxidanylidene-ethyl] 6-chloranylpyridine-3-carboxylate

Systemtic Name: [2-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)-2-oxidanylidene-ethyl] 6-chloranylpyridine-3-carboxylate Openeye Name: [2-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-oxo-ethyl] 6-chloropyridine-3-carboxylate CAS Name: 6-chloro-3-pyridinecarboxylic acid [2-(6-ethoxy-2,2,4-trimethyl-1-quinolinyl)-2-oxoethyl] ester IUPAC Name: [2-(6-ethoxy-2,2,4-trimethylquinolin-1-yl)-2-oxoethyl] 6-chloropyridine-3-carboxylate Traditional Name: 6-chloronicotinic acid [2-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-keto-ethyl] ester Formula: C22H23ClN2O4 MolecularWeight: 414.88202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)COC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)COC(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C22H23ClN2O4/c1-5-28-16-7-8-18-17(10-16)14(2)11-22(3,4)25(18)20(26)13-29-21(27)15-6-9-19(23)24-12-15/h6-12H,5,13H2,1-4H3