1-[3-[3-(dimethylamino)propyl-methyl-amino]piperidin-1-yl]-2-(3-methylphenyl)ethanone

Systemtic Name: 1-[3-[3-(dimethylamino)propyl-methyl-amino]piperidin-1-yl]-2-(3-methylphenyl)ethanone Openeye Name: 1-[3-[3-(dimethylamino)propyl-methyl-amino]-1-piperidyl]-2-(m-tolyl)ethanone CAS Name: 1-[3-[3-(dimethylamino)propyl-methylamino]-1-piperidinyl]-2-(3-methylphenyl)ethanone IUPAC Name: 1-[3-[3-(dimethylamino)propyl-methylamino]piperidin-1-yl]-2-(3-methylphenyl)ethanone Traditional Name: 1-[3-[3-(dimethylamino)propyl-methyl-amino]piperidino]-2-(m-tolyl)ethanone Formula: C20H33N3O MolecularWeight: 331.49552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(=O)N2CCCC(C2)N(C)CCCN(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CC(=O)N2CCCC(C2)N(C)CCCN(C)C

InChI

InChI=1S/C20H33N3O/c1-17-8-5-9-18(14-17)15-20(24)23-13-6-10-19(16-23)22(4)12-7-11-21(2)3/h5,8-9,14,19H,6-7,10-13,15-16H2,1-4H3