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

Systemtic Name: 3-(1-methylpiperidin-4-yl)-4-phenyl-2H-isoquinolin-1-one Openeye Name: 3-(1-methyl-4-piperidyl)-4-phenyl-2H-isoquinolin-1-one CAS Name: 3-(1-methyl-4-piperidinyl)-4-phenyl-2H-isoquinolin-1-one IUPAC Name: 3-(1-methylpiperidin-4-yl)-4-phenyl-2H-isoquinolin-1-one Traditional Name: 3-(1-methyl-4-piperidyl)-4-phenyl-isocarbostyril Formula: C21H22N2O MolecularWeight: 318.41218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O/c1-23-13-11-16(12-14-23)20-19(15-7-3-2-4-8-15)17-9-5-6-10-18(17)21(24)22-20/h2-10,16H,11-14H2,1H3,(H,22,24)