5-methyl-3-[1-(3-oxidanylpropyl)piperidin-4-yl]-2H-isoquinolin-1-one

Systemtic Name: 5-methyl-3-[1-(3-oxidanylpropyl)piperidin-4-yl]-2H-isoquinolin-1-one Openeye Name: 3-[1-(3-hydroxypropyl)-4-piperidyl]-5-methyl-2H-isoquinolin-1-one CAS Name: 3-[1-(3-hydroxypropyl)-4-piperidinyl]-5-methyl-2H-isoquinolin-1-one IUPAC Name: 3-[1-(3-hydroxypropyl)piperidin-4-yl]-5-methyl-2H-isoquinolin-1-one Traditional Name: 3-[1-(3-hydroxypropyl)-4-piperidyl]-5-methyl-isocarbostyril Formula: C18H24N2O2 MolecularWeight: 300.39536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=C(NC2=O)C3CCN(CC3)CCCO

Isomeric SMILES

CC1=CC=CC2=C1C=C(NC2=O)C3CCN(CC3)CCCO

InChI

InChI=1S/C18H24N2O2/c1-13-4-2-5-15-16(13)12-17(19-18(15)22)14-6-9-20(10-7-14)8-3-11-21/h2,4-5,12,14,21H,3,6-11H2,1H3,(H,19,22)