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

Systemtic Name: 1-methyl-4-(phenylcarbonyl)-7-pyridin-4-yl-5,6,7,8-tetrahydro-2H-isoquinolin-3-one Openeye Name: 4-benzoyl-1-methyl-7-(4-pyridyl)-5,6,7,8-tetrahydro-2H-isoquinolin-3-one CAS Name: 4-benzoyl-1-methyl-7-pyridin-4-yl-5,6,7,8-tetrahydro-2H-isoquinolin-3-one IUPAC Name: 4-benzoyl-1-methyl-7-pyridin-4-yl-5,6,7,8-tetrahydro-2H-isoquinolin-3-one Traditional Name: 4-benzoyl-1-methyl-7-(4-pyridyl)-5,6,7,8-tetrahydro-2H-isoquinolin-3-one Formula: C22H20N2O2 MolecularWeight: 344.4064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CC(CCC2=C(C(=O)N1)C(=O)C3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CC1=C2CC(CCC2=C(C(=O)N1)C(=O)C3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C22H20N2O2/c1-14-19-13-17(15-9-11-23-12-10-15)7-8-18(19)20(22(26)24-14)21(25)16-5-3-2-4-6-16/h2-6,9-12,17H,7-8,13H2,1H3,(H,24,26)