2-[[2-cyclopropylcarbonyl-1-(3-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methylpiperazin-1-yl)butan-1-one

Systemtic Name: 2-[[2-cyclopropylcarbonyl-1-(3-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methylpiperazin-1-yl)butan-1-one Openeye Name: 2-[[2-(cyclopropanecarbonyl)-1-(m-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methylpiperazin-1-yl)butan-1-one CAS Name: 2-[[2-[cyclopropyl(oxo)methyl]-1-(3-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methyl-1-piperazinyl)-1-butanone IUPAC Name: 2-[[2-(cyclopropanecarbonyl)-1-(3-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methylpiperazin-1-yl)butan-1-one Traditional Name: 2-[[2-(cyclopropanecarbonyl)-1-(m-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-methylpiperazino)butan-1-one Formula: C29H37N3O3 MolecularWeight: 475.62238

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)C)OC2=CC3=C(CCN(C3C4=CC(=CC=C4)C)C(=O)C5CC5)C=C2

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)C)OC2=CC3=C(CCN(C3C4=CC(=CC=C4)C)C(=O)C5CC5)C=C2

InChI

InChI=1S/C29H37N3O3/c1-4-26(29(34)31-16-14-30(3)15-17-31)35-24-11-10-21-12-13-32(28(33)22-8-9-22)27(25(21)19-24)23-7-5-6-20(2)18-23/h5-7,10-11,18-19,22,26-27H,4,8-9,12-17H2,1-3H3