3-[4-(dimethylamino)piperidin-1-yl]-5-methoxy-2H-isoquinolin-1-one

Systemtic Name: 3-[4-(dimethylamino)piperidin-1-yl]-5-methoxy-2H-isoquinolin-1-one Openeye Name: 3-[4-(dimethylamino)-1-piperidyl]-5-methoxy-2H-isoquinolin-1-one CAS Name: 3-[4-(dimethylamino)-1-piperidinyl]-5-methoxy-2H-isoquinolin-1-one IUPAC Name: 3-[4-(dimethylamino)piperidin-1-yl]-5-methoxy-2H-isoquinolin-1-one Traditional Name: 3-[4-(dimethylamino)piperidino]-5-methoxy-isocarbostyril Formula: C17H23N3O2 MolecularWeight: 301.38342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(CC1)C2=CC3=C(C=CC=C3OC)C(=O)N2

Isomeric SMILES

CN(C)C1CCN(CC1)C2=CC3=C(C=CC=C3OC)C(=O)N2

InChI

InChI=1S/C17H23N3O2/c1-19(2)12-7-9-20(10-8-12)16-11-14-13(17(21)18-16)5-4-6-15(14)22-3/h4-6,11-12H,7-10H2,1-3H3,(H,18,21)