N-[3-(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)propyl]-N-methyl-3-pyridin-4-yl-propan-1-amine dihydrate dihydrochloride

Systemtic Name: N-[3-(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)propyl]-N-methyl-3-pyridin-4-yl-propan-1-amine dihydrate dihydrochloride Openeye Name: N-[3-(5,6-dimethoxyisoindolin-2-yl)propyl]-N-methyl-3-(4-pyridyl)propan-1-amine dihydrate dihydrochloride CAS Name: N-[3-(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)propyl]-N-methyl-3-pyridin-4-yl-1-propanamine dihydrate dihydrochloride IUPAC Name: N-[3-(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)propyl]-N-methyl-3-pyridin-4-ylpropan-1-amine dihydrate dihydrochloride Traditional Name: 3-(5,6-dimethoxyisoindolin-2-yl)propyl-methyl-[3-(4-pyridyl)propyl]amine dihydrate dihydrochloride Formula: C22H37Cl2N3O4 MolecularWeight: 478.45288

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=CC=NC=C1)CCCN2CC3=CC(=C(C=C3C2)OC)OC.O.O.Cl.Cl

Isomeric SMILES

CN(CCCC1=CC=NC=C1)CCCN2CC3=CC(=C(C=C3C2)OC)OC.O.O.Cl.Cl

InChI

InChI=1S/C22H31N3O2.2ClH.2H2O/c1-24(11-4-6-18-7-9-23-10-8-18)12-5-13-25-16-19-14-21(26-2)22(27-3)15-20(19)17-25;;;;/h7-10,14-15H,4-6,11-13,16-17H2,1-3H3;2*1H;2*1H2