5-methyl-3-(2-piperidin-1-ylethyl)-2H-isoquinolin-1-one

Systemtic Name: 5-methyl-3-(2-piperidin-1-ylethyl)-2H-isoquinolin-1-one Openeye Name: 5-methyl-3-[2-(1-piperidyl)ethyl]-2H-isoquinolin-1-one CAS Name: 5-methyl-3-[2-(1-piperidinyl)ethyl]-2H-isoquinolin-1-one IUPAC Name: 5-methyl-3-(2-piperidin-1-ylethyl)-2H-isoquinolin-1-one Traditional Name: 5-methyl-3-(2-piperidinoethyl)isocarbostyril Formula: C17H22N2O MolecularWeight: 270.36938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=C(NC2=O)CCN3CCCCC3

Isomeric SMILES

CC1=CC=CC2=C1C=C(NC2=O)CCN3CCCCC3

InChI

InChI=1S/C17H22N2O/c1-13-6-5-7-15-16(13)12-14(18-17(15)20)8-11-19-9-3-2-4-10-19/h5-7,12H,2-4,8-11H2,1H3,(H,18,20)