5,8,8-trimethyl-3-[3-[2-(2-methylphenyl)piperazin-1-yl]propyl]-3-azabicyclo[3.2.1]octane-2,4-dione dihydrochloride

Systemtic Name: 5,8,8-trimethyl-3-[3-[2-(2-methylphenyl)piperazin-1-yl]propyl]-3-azabicyclo[3.2.1]octane-2,4-dione dihydrochloride Openeye Name: 5,8,8-trimethyl-3-[3-[2-(o-tolyl)piperazin-1-yl]propyl]-3-azabicyclo[3.2.1]octane-2,4-dione dihydrochloride CAS Name: 5,8,8-trimethyl-3-[3-[2-(2-methylphenyl)-1-piperazinyl]propyl]-3-azabicyclo[3.2.1]octane-2,4-dione dihydrochloride IUPAC Name: 5,8,8-trimethyl-3-[3-[2-(2-methylphenyl)piperazin-1-yl]propyl]-3-azabicyclo[3.2.1]octane-2,4-dione dihydrochloride Traditional Name: 5,8,8-trimethyl-3-[3-[2-(o-tolyl)piperazino]propyl]-3-azabicyclo[3.2.1]octane-2,4-quinone dihydrochloride Formula: C24H37Cl2N3O2 MolecularWeight: 470.47548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2CNCCN2CCCN3C(=O)C4CCC(C3=O)(C4(C)C)C.Cl.Cl

Isomeric SMILES

CC1=CC=CC=C1C2CNCCN2CCCN3C(=O)C4CCC(C3=O)(C4(C)C)C.Cl.Cl

InChI

InChI=1S/C24H35N3O2.2ClH/c1-17-8-5-6-9-18(17)20-16-25-12-15-26(20)13-7-14-27-21(28)19-10-11-24(4,22(27)29)23(19,2)3;;/h5-6,8-9,19-20,25H,7,10-16H2,1-4H3;2*1H