6,7-dimethyl-2-[4-[methyl(pyridin-3-yl)amino]butan-2-yl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6,7-dimethyl-2-[4-[methyl(pyridin-3-yl)amino]butan-2-yl]-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethyl-2-[1-methyl-3-[methyl(3-pyridyl)amino]propyl]-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethyl-2-[4-[methyl(3-pyridinyl)amino]butan-2-yl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethyl-2-[4-[methyl(pyridin-3-yl)amino]butan-2-yl]-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethyl-2-[1-methyl-3-[methyl(3-pyridyl)amino]propyl]-3,4-dihydroisocarbostyril Formula: C21H27N3O MolecularWeight: 337.45858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CCN(C2=O)C(C)CCN(C)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CCN(C2=O)C(C)CCN(C)C3=CN=CC=C3)C

InChI

InChI=1S/C21H27N3O/c1-15-12-18-8-11-24(21(25)20(18)13-16(15)2)17(3)7-10-23(4)19-6-5-9-22-14-19/h5-6,9,12-14,17H,7-8,10-11H2,1-4H3