1-methyl-4-propyl-7-pyridin-4-yl-5,6,7,8-tetrahydro-2H-isoquinolin-3-one

Systemtic Name: 1-methyl-4-propyl-7-pyridin-4-yl-5,6,7,8-tetrahydro-2H-isoquinolin-3-one Openeye Name: 1-methyl-4-propyl-7-(4-pyridyl)-5,6,7,8-tetrahydro-2H-isoquinolin-3-one CAS Name: 1-methyl-4-propyl-7-pyridin-4-yl-5,6,7,8-tetrahydro-2H-isoquinolin-3-one IUPAC Name: 1-methyl-4-propyl-7-pyridin-4-yl-5,6,7,8-tetrahydro-2H-isoquinolin-3-one Traditional Name: 1-methyl-4-propyl-7-(4-pyridyl)-5,6,7,8-tetrahydro-2H-isoquinolin-3-one Formula: C18H22N2O MolecularWeight: 282.38008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2CCC(CC2=C(NC1=O)C)C3=CC=NC=C3

Isomeric SMILES

CCCC1=C2CCC(CC2=C(NC1=O)C)C3=CC=NC=C3

InChI

InChI=1S/C18H22N2O/c1-3-4-16-15-6-5-14(13-7-9-19-10-8-13)11-17(15)12(2)20-18(16)21/h7-10,14H,3-6,11H2,1-2H3,(H,20,21)