2-piperazin-1-yl-3-(4-piperidin-1-ylbutyl)isoquinolin-1-one

Systemtic Name: 2-piperazin-1-yl-3-(4-piperidin-1-ylbutyl)isoquinolin-1-one Openeye Name: 2-piperazin-1-yl-3-[4-(1-piperidyl)butyl]isoquinolin-1-one CAS Name: 2-(1-piperazinyl)-3-[4-(1-piperidinyl)butyl]-1-isoquinolinone IUPAC Name: 2-piperazin-1-yl-3-(4-piperidin-1-ylbutyl)isoquinolin-1-one Traditional Name: 2-piperazino-3-(4-piperidinobutyl)isocarbostyril Formula: C22H32N4O MolecularWeight: 368.51568

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCC2=CC3=CC=CC=C3C(=O)N2N4CCNCC4

Isomeric SMILES

C1CCN(CC1)CCCCC2=CC3=CC=CC=C3C(=O)N2N4CCNCC4

InChI

InChI=1S/C22H32N4O/c27-22-21-10-3-2-8-19(21)18-20(26(22)25-16-11-23-12-17-25)9-4-7-15-24-13-5-1-6-14-24/h2-3,8,10,18,23H,1,4-7,9,11-17H2