5-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethoxy]-2H-isoquinolin-1-one

Systemtic Name: 5-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethoxy]-2H-isoquinolin-1-one Openeye Name: 5-[2-(4-methyl-1-piperidyl)-2-oxo-ethoxy]-2H-isoquinolin-1-one CAS Name: 5-[2-(4-methyl-1-piperidinyl)-2-oxoethoxy]-2H-isoquinolin-1-one IUPAC Name: 5-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]-2H-isoquinolin-1-one Traditional Name: 5-[2-keto-2-(4-methylpiperidino)ethoxy]isocarbostyril Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)COC2=CC=CC3=C2C=CNC3=O

Isomeric SMILES

CC1CCN(CC1)C(=O)COC2=CC=CC3=C2C=CNC3=O

InChI

InChI=1S/C17H20N2O3/c1-12-6-9-19(10-7-12)16(20)11-22-15-4-2-3-14-13(15)5-8-18-17(14)21/h2-5,8,12H,6-7,9-11H2,1H3,(H,18,21)