2-[[2-cyclopentylcarbonyl-1-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[2-cyclopentylcarbonyl-1-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methylpiperazin-1-yl)ethanone Openeye Name: 2-[[2-(cyclopentanecarbonyl)-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methylpiperazin-1-yl)ethanone CAS Name: 2-[[2-[cyclopentyl(oxo)methyl]-1-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 2-[[2-(cyclopentanecarbonyl)-1-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methylpiperazin-1-yl)ethanone Traditional Name: 2-[[2-(cyclopentanecarbonyl)-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methylpiperazino)ethanone Formula: C29H37N3O3 MolecularWeight: 475.62238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3=C(CCN2C(=O)C4CCCC4)C=CC(=C3)OCC(=O)N5CCN(CC5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2C3=C(CCN2C(=O)C4CCCC4)C=CC(=C3)OCC(=O)N5CCN(CC5)C

InChI

InChI=1S/C29H37N3O3/c1-21-7-9-23(10-8-21)28-26-19-25(35-20-27(33)31-17-15-30(2)16-18-31)12-11-22(26)13-14-32(28)29(34)24-5-3-4-6-24/h7-12,19,24,28H,3-6,13-18,20H2,1-2H3