5-methyl-2-[2-(3-oxidanylpiperidin-1-yl)ethyl]isoquinolin-1-one

Systemtic Name: 5-methyl-2-[2-(3-oxidanylpiperidin-1-yl)ethyl]isoquinolin-1-one Openeye Name: 2-[2-(3-hydroxy-1-piperidyl)ethyl]-5-methyl-isoquinolin-1-one CAS Name: 2-[2-(3-hydroxy-1-piperidinyl)ethyl]-5-methyl-1-isoquinolinone IUPAC Name: 2-[2-(3-hydroxypiperidin-1-yl)ethyl]-5-methylisoquinolin-1-one Traditional Name: 2-[2-(3-hydroxypiperidino)ethyl]-5-methyl-isocarbostyril Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=CN(C2=O)CCN3CCCC(C3)O

Isomeric SMILES

CC1=CC=CC2=C1C=CN(C2=O)CCN3CCCC(C3)O

InChI

InChI=1S/C17H22N2O2/c1-13-4-2-6-16-15(13)7-9-19(17(16)21)11-10-18-8-3-5-14(20)12-18/h2,4,6-7,9,14,20H,3,5,8,10-12H2,1H3