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

Systemtic Name: 4-(2-fluorophenyl)-3-(1-methylpiperidin-4-yl)-2H-isoquinolin-1-one Openeye Name: 4-(2-fluorophenyl)-3-(1-methyl-4-piperidyl)-2H-isoquinolin-1-one CAS Name: 4-(2-fluorophenyl)-3-(1-methyl-4-piperidinyl)-2H-isoquinolin-1-one IUPAC Name: 4-(2-fluorophenyl)-3-(1-methylpiperidin-4-yl)-2H-isoquinolin-1-one Traditional Name: 4-(2-fluorophenyl)-3-(1-methyl-4-piperidyl)isocarbostyril Formula: C21H21FN2O MolecularWeight: 336.402643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2=C(C3=CC=CC=C3C(=O)N2)C4=CC=CC=C4F

Isomeric SMILES

CN1CCC(CC1)C2=C(C3=CC=CC=C3C(=O)N2)C4=CC=CC=C4F

InChI

InChI=1S/C21H21FN2O/c1-24-12-10-14(11-13-24)20-19(17-8-4-5-9-18(17)22)15-6-2-3-7-16(15)21(25)23-20/h2-9,14H,10-13H2,1H3,(H,23,25)