4-[1-(phenylcarbonyl)piperidin-4-yl]-2H-isoquinolin-1-one

Systemtic Name: 4-[1-(phenylcarbonyl)piperidin-4-yl]-2H-isoquinolin-1-one Openeye Name: 4-(1-benzoyl-4-piperidyl)-2H-isoquinolin-1-one CAS Name: 4-(1-benzoyl-4-piperidinyl)-2H-isoquinolin-1-one IUPAC Name: 4-(1-benzoylpiperidin-4-yl)-2H-isoquinolin-1-one Traditional Name: 4-(1-benzoyl-4-piperidyl)isocarbostyril Formula: C21H20N2O2 MolecularWeight: 332.3957

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CNC(=O)C3=CC=CC=C32)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C2=CNC(=O)C3=CC=CC=C32)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O2/c24-20-18-9-5-4-8-17(18)19(14-22-20)15-10-12-23(13-11-15)21(25)16-6-2-1-3-7-16/h1-9,14-15H,10-13H2,(H,22,24)