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

Systemtic Name: 5-methyl-3-[4-(3-piperidin-1-ylpropyl)piperazin-1-yl]-2H-isoquinolin-1-one Openeye Name: 5-methyl-3-[4-[3-(1-piperidyl)propyl]piperazin-1-yl]-2H-isoquinolin-1-one CAS Name: 5-methyl-3-[4-[3-(1-piperidinyl)propyl]-1-piperazinyl]-2H-isoquinolin-1-one IUPAC Name: 5-methyl-3-[4-(3-piperidin-1-ylpropyl)piperazin-1-yl]-2H-isoquinolin-1-one Traditional Name: 5-methyl-3-[4-(3-piperidinopropyl)piperazino]isocarbostyril Formula: C22H32N4O MolecularWeight: 368.51568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=C(NC2=O)N3CCN(CC3)CCCN4CCCCC4

Isomeric SMILES

CC1=CC=CC2=C1C=C(NC2=O)N3CCN(CC3)CCCN4CCCCC4

InChI

InChI=1S/C22H32N4O/c1-18-7-5-8-19-20(18)17-21(23-22(19)27)26-15-13-25(14-16-26)12-6-11-24-9-3-2-4-10-24/h5,7-8,17H,2-4,6,9-16H2,1H3,(H,23,27)