4-(4-methylphenyl)-3-(1-methylpiperidin-4-yl)-2H-isoquinolin-1-one

Systemtic Name: 4-(4-methylphenyl)-3-(1-methylpiperidin-4-yl)-2H-isoquinolin-1-one Openeye Name: 3-(1-methyl-4-piperidyl)-4-(p-tolyl)-2H-isoquinolin-1-one CAS Name: 4-(4-methylphenyl)-3-(1-methyl-4-piperidinyl)-2H-isoquinolin-1-one IUPAC Name: 4-(4-methylphenyl)-3-(1-methylpiperidin-4-yl)-2H-isoquinolin-1-one Traditional Name: 3-(1-methyl-4-piperidyl)-4-(p-tolyl)isocarbostyril Formula: C22H24N2O MolecularWeight: 332.43876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(NC(=O)C3=CC=CC=C32)C4CCN(CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(NC(=O)C3=CC=CC=C32)C4CCN(CC4)C

InChI

InChI=1S/C22H24N2O/c1-15-7-9-16(10-8-15)20-18-5-3-4-6-19(18)22(25)23-21(20)17-11-13-24(2)14-12-17/h3-10,17H,11-14H2,1-2H3,(H,23,25)