1-[1,2-dimethyl-2-phenyl-3-(2-propan-2-yloxyphenyl)pyrrolidin-3-yl]piperazine hydrate dihydrochloride

Systemtic Name: 1-[1,2-dimethyl-2-phenyl-3-(2-propan-2-yloxyphenyl)pyrrolidin-3-yl]piperazine hydrate dihydrochloride Openeye Name: 1-[3-(2-isopropoxyphenyl)-1,2-dimethyl-2-phenyl-pyrrolidin-3-yl]piperazine hydrate dihydrochloride CAS Name: 1-[1,2-dimethyl-2-phenyl-3-(2-propan-2-yloxyphenyl)-3-pyrrolidinyl]piperazine hydrate dihydrochloride IUPAC Name: 1-[1,2-dimethyl-2-phenyl-3-(2-propan-2-yloxyphenyl)pyrrolidin-3-yl]piperazine hydrate dihydrochloride Traditional Name: 1-[3-(2-isopropoxyphenyl)-1,2-dimethyl-2-phenyl-pyrrolidin-3-yl]piperazine hydrate dihydrochloride Formula: C25H39Cl2N3O2 MolecularWeight: 484.50206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C2(CCN(C2(C)C3=CC=CC=C3)C)N4CCNCC4.O.Cl.Cl

Isomeric SMILES

CC(C)OC1=CC=CC=C1C2(CCN(C2(C)C3=CC=CC=C3)C)N4CCNCC4.O.Cl.Cl

InChI

InChI=1S/C25H35N3O.2ClH.H2O/c1-20(2)29-23-13-9-8-12-22(23)25(28-18-15-26-16-19-28)14-17-27(4)24(25,3)21-10-6-5-7-11-21;;;/h5-13,20,26H,14-19H2,1-4H3;2*1H;1H2