(2-chloranyl-7-methyl-quinolin-3-yl)methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: (2-chloranyl-7-methyl-quinolin-3-yl)methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate Openeye Name: (2-chloro-7-methyl-3-quinolyl)methyl 4-oxo-4-(p-tolyl)butanoate CAS Name: 4-(4-methylphenyl)-4-oxobutanoic acid (2-chloro-7-methyl-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methylquinolin-3-yl)methyl 4-(4-methylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-(p-tolyl)butyric acid (2-chloro-7-methyl-3-quinolyl)methyl ester Formula: C22H20ClNO3 MolecularWeight: 381.8521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=C(N=C3C=C(C=CC3=C2)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=C(N=C3C=C(C=CC3=C2)C)Cl

InChI

InChI=1S/C22H20ClNO3/c1-14-3-6-16(7-4-14)20(25)9-10-21(26)27-13-18-12-17-8-5-15(2)11-19(17)24-22(18)23/h3-8,11-12H,9-10,13H2,1-2H3