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

Systemtic Name: 1-methyl-4-prop-1-en-2-yl-7-pyridin-4-yl-5,6,7,8-tetrahydro-2H-isoquinolin-3-one Openeye Name: 4-isopropenyl-1-methyl-7-(4-pyridyl)-5,6,7,8-tetrahydro-2H-isoquinolin-3-one CAS Name: 1-methyl-4-(1-methylethenyl)-7-pyridin-4-yl-5,6,7,8-tetrahydro-2H-isoquinolin-3-one IUPAC Name: 1-methyl-4-prop-1-en-2-yl-7-pyridin-4-yl-5,6,7,8-tetrahydro-2H-isoquinolin-3-one Traditional Name: 4-isopropenyl-1-methyl-7-(4-pyridyl)-5,6,7,8-tetrahydro-2H-isoquinolin-3-one Formula: C18H20N2O MolecularWeight: 280.3642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CC(CCC2=C(C(=O)N1)C(=C)C)C3=CC=NC=C3

Isomeric SMILES

CC1=C2CC(CCC2=C(C(=O)N1)C(=C)C)C3=CC=NC=C3

InChI

InChI=1S/C18H20N2O/c1-11(2)17-15-5-4-14(13-6-8-19-9-7-13)10-16(15)12(3)20-18(17)21/h6-9,14H,1,4-5,10H2,2-3H3,(H,20,21)