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

Systemtic Name: 3-[4-(dimethylamino)cyclohexyl]-2H-isoquinolin-1-one Openeye Name: 3-[4-(dimethylamino)cyclohexyl]-2H-isoquinolin-1-one CAS Name: 3-[4-(dimethylamino)cyclohexyl]-2H-isoquinolin-1-one IUPAC Name: 3-[4-(dimethylamino)cyclohexyl]-2H-isoquinolin-1-one Traditional Name: 3-[4-(dimethylamino)cyclohexyl]isocarbostyril Formula: C17H22N2O MolecularWeight: 270.36938

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCC(CC1)C2=CC3=CC=CC=C3C(=O)N2

Isomeric SMILES

CN(C)C1CCC(CC1)C2=CC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C17H22N2O/c1-19(2)14-9-7-12(8-10-14)16-11-13-5-3-4-6-15(13)17(20)18-16/h3-6,11-12,14H,7-10H2,1-2H3,(H,18,20)