3-[4-(dimethylamino)piperazin-1-yl]-2H-isoquinolin-1-one

Systemtic Name: 3-[4-(dimethylamino)piperazin-1-yl]-2H-isoquinolin-1-one Openeye Name: 3-[4-(dimethylamino)piperazin-1-yl]-2H-isoquinolin-1-one CAS Name: 3-[4-(dimethylamino)-1-piperazinyl]-2H-isoquinolin-1-one IUPAC Name: 3-[4-(dimethylamino)piperazin-1-yl]-2H-isoquinolin-1-one Traditional Name: 3-[4-(dimethylamino)piperazino]isocarbostyril Formula: C15H20N4O MolecularWeight: 272.3455

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)N1CCN(CC1)C2=CC3=CC=CC=C3C(=O)N2

Isomeric SMILES

CN(C)N1CCN(CC1)C2=CC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C15H20N4O/c1-17(2)19-9-7-18(8-10-19)14-11-12-5-3-4-6-13(12)15(20)16-14/h3-6,11H,7-10H2,1-2H3,(H,16,20)