3-[1-(2,2-dimethyl-3-oxidanyl-propyl)piperidin-4-yl]-2H-isoquinolin-1-one

Systemtic Name: 3-[1-(2,2-dimethyl-3-oxidanyl-propyl)piperidin-4-yl]-2H-isoquinolin-1-one Openeye Name: 3-[1-(3-hydroxy-2,2-dimethyl-propyl)-4-piperidyl]-2H-isoquinolin-1-one CAS Name: 3-[1-(3-hydroxy-2,2-dimethylpropyl)-4-piperidinyl]-2H-isoquinolin-1-one IUPAC Name: 3-[1-(3-hydroxy-2,2-dimethylpropyl)piperidin-4-yl]-2H-isoquinolin-1-one Traditional Name: 3-[1-(3-hydroxy-2,2-dimethyl-propyl)-4-piperidyl]isocarbostyril Formula: C19H26N2O2 MolecularWeight: 314.42194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CCC(CC1)C2=CC3=CC=CC=C3C(=O)N2)CO

Isomeric SMILES

CC(C)(CN1CCC(CC1)C2=CC3=CC=CC=C3C(=O)N2)CO

InChI

InChI=1S/C19H26N2O2/c1-19(2,13-22)12-21-9-7-14(8-10-21)17-11-15-5-3-4-6-16(15)18(23)20-17/h3-6,11,14,22H,7-10,12-13H2,1-2H3,(H,20,23)