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

Systemtic Name: 5-methyl-3-(3-piperidin-1-ylpropyl)-2H-isoquinolin-1-one Openeye Name: 5-methyl-3-[3-(1-piperidyl)propyl]-2H-isoquinolin-1-one CAS Name: 5-methyl-3-[3-(1-piperidinyl)propyl]-2H-isoquinolin-1-one IUPAC Name: 5-methyl-3-(3-piperidin-1-ylpropyl)-2H-isoquinolin-1-one Traditional Name: 5-methyl-3-(3-piperidinopropyl)isocarbostyril Formula: C18H24N2O MolecularWeight: 284.39596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=C(NC2=O)CCCN3CCCCC3

Isomeric SMILES

CC1=CC=CC2=C1C=C(NC2=O)CCCN3CCCCC3

InChI

InChI=1S/C18H24N2O/c1-14-7-5-9-16-17(14)13-15(19-18(16)21)8-6-12-20-10-3-2-4-11-20/h5,7,9,13H,2-4,6,8,10-12H2,1H3,(H,19,21)