1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(4-methylphenyl)-2-piperidin-1-yl-butane-1,4-dione

Systemtic Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(4-methylphenyl)-2-piperidin-1-yl-butane-1,4-dione Openeye Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(1-piperidyl)-4-(p-tolyl)butane-1,4-dione CAS Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(4-methylphenyl)-2-(1-piperidinyl)butane-1,4-dione IUPAC Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(4-methylphenyl)-2-piperidin-1-ylbutane-1,4-dione Traditional Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-piperidino-4-(p-tolyl)butane-1,4-dione Formula: C26H32N2O2 MolecularWeight: 404.54448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CC(C(=O)C2=CC3=C(CCN(C3)C)C=C2)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CC(C(=O)C2=CC3=C(CCN(C3)C)C=C2)N4CCCCC4

InChI

InChI=1S/C26H32N2O2/c1-19-6-8-21(9-7-19)25(29)17-24(28-13-4-3-5-14-28)26(30)22-11-10-20-12-15-27(2)18-23(20)16-22/h6-11,16,24H,3-5,12-15,17-18H2,1-2H3