3-[4-(dimethylamino)piperidin-1-yl]-6,7-bis(oxidanyl)-2H-isoquinolin-1-one

Systemtic Name: 3-[4-(dimethylamino)piperidin-1-yl]-6,7-bis(oxidanyl)-2H-isoquinolin-1-one Openeye Name: 3-[4-(dimethylamino)-1-piperidyl]-6,7-dihydroxy-2H-isoquinolin-1-one CAS Name: 3-[4-(dimethylamino)-1-piperidinyl]-6,7-dihydroxy-2H-isoquinolin-1-one IUPAC Name: 3-[4-(dimethylamino)piperidin-1-yl]-6,7-dihydroxy-2H-isoquinolin-1-one Traditional Name: 3-[4-(dimethylamino)piperidino]-6,7-dihydroxy-isocarbostyril Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(CC1)C2=CC3=CC(=C(C=C3C(=O)N2)O)O

Isomeric SMILES

CN(C)C1CCN(CC1)C2=CC3=CC(=C(C=C3C(=O)N2)O)O

InChI

InChI=1S/C16H21N3O3/c1-18(2)11-3-5-19(6-4-11)15-8-10-7-13(20)14(21)9-12(10)16(22)17-15/h7-9,11,20-21H,3-6H2,1-2H3,(H,17,22)