N,N-dimethyl-3-[3-(phenylmethyl)-3,9-diazabicyclo[3.3.1]nonan-9-yl]propan-1-amine trihydrate trihydrochloride

Systemtic Name: N,N-dimethyl-3-[3-(phenylmethyl)-3,9-diazabicyclo[3.3.1]nonan-9-yl]propan-1-amine trihydrate trihydrochloride Openeye Name: 3-(3-benzyl-3,9-diazabicyclo[3.3.1]nonan-9-yl)-N,N-dimethyl-propan-1-amine trihydrate trihydrochloride CAS Name: N,N-dimethyl-3-[3-(phenylmethyl)-3,9-diazabicyclo[3.3.1]nonan-9-yl]-1-propanamine trihydrate trihydrochloride IUPAC Name: 3-(3-benzyl-3,9-diazabicyclo[3.3.1]nonan-9-yl)-N,N-dimethylpropan-1-amine trihydrate trihydrochloride Traditional Name: 3-(3-benzyl-3,9-diazabicyclo[3.3.1]nonan-9-yl)propyl-dimethyl-amine trihydrate trihydrochloride Formula: C19H40Cl3N3O3 MolecularWeight: 464.8982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2CCCC1CN(C2)CC3=CC=CC=C3.O.O.O.Cl.Cl.Cl

Isomeric SMILES

CN(C)CCCN1C2CCCC1CN(C2)CC3=CC=CC=C3.O.O.O.Cl.Cl.Cl

InChI

InChI=1S/C19H31N3.3ClH.3H2O/c1-20(2)12-7-13-22-18-10-6-11-19(22)16-21(15-18)14-17-8-4-3-5-9-17;;;;;;/h3-5,8-9,18-19H,6-7,10-16H2,1-2H3;3*1H;3*1H2