ethyl 4-(4-chlorophenyl)-2,7,7-trimethyl-5-oxidanylidene-6,8-dihydroquinoline-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2,7,7-trimethyl-5-oxidanylidene-6,8-dihydroquinoline-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2,7,7-trimethyl-5-oxo-6,8-dihydroquinoline-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2,7,7-trimethyl-5-oxo-6,8-dihydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2,7,7-trimethyl-5-oxo-6,8-dihydroquinoline-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-5-keto-2,7,7-trimethyl-6,8-dihydroquinoline-3-carboxylic acid ethyl ester Formula: C21H22ClNO3 MolecularWeight: 371.85728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2CC(CC(=O)C2=C1C3=CC=C(C=C3)Cl)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2CC(CC(=O)C2=C1C3=CC=C(C=C3)Cl)(C)C)C

InChI

InChI=1S/C21H22ClNO3/c1-5-26-20(25)17-12(2)23-15-10-21(3,4)11-16(24)19(15)18(17)13-6-8-14(22)9-7-13/h6-9H,5,10-11H2,1-4H3