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

Systemtic Name: 3-(4-morpholin-4-ylbutyl)-2-piperazin-1-yl-isoquinolin-1-one Openeye Name: 3-(4-morpholinobutyl)-2-piperazin-1-yl-isoquinolin-1-one CAS Name: 3-[4-(4-morpholinyl)butyl]-2-(1-piperazinyl)-1-isoquinolinone IUPAC Name: 3-(4-morpholin-4-ylbutyl)-2-piperazin-1-ylisoquinolin-1-one Traditional Name: 3-(4-morpholinobutyl)-2-piperazino-isocarbostyril Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)N2C(=CC3=CC=CC=C3C2=O)CCCCN4CCOCC4

Isomeric SMILES

C1CN(CCN1)N2C(=CC3=CC=CC=C3C2=O)CCCCN4CCOCC4

InChI

InChI=1S/C21H30N4O2/c26-21-20-7-2-1-5-18(20)17-19(25(21)24-11-8-22-9-12-24)6-3-4-10-23-13-15-27-16-14-23/h1-2,5,7,17,22H,3-4,6,8-16H2