3-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-2H-isoquinolin-1-one

Systemtic Name: 3-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-2H-isoquinolin-1-one Openeye Name: 3-[2-[2-(hydroxymethyl)-1-piperidyl]ethyl]-2H-isoquinolin-1-one CAS Name: 3-[2-[2-(hydroxymethyl)-1-piperidinyl]ethyl]-2H-isoquinolin-1-one IUPAC Name: 3-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-2H-isoquinolin-1-one Traditional Name: 3-[2-(2-methylolpiperidino)ethyl]isocarbostyril Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CO)CCC2=CC3=CC=CC=C3C(=O)N2

Isomeric SMILES

C1CCN(C(C1)CO)CCC2=CC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C17H22N2O2/c20-12-15-6-3-4-9-19(15)10-8-14-11-13-5-1-2-7-16(13)17(21)18-14/h1-2,5,7,11,15,20H,3-4,6,8-10,12H2,(H,18,21)