2-(4-aminophenyl)-N-methyl-N-[1-(3-oxidanylpyrrolidin-1-yl)-2-phenyl-ethyl]ethanamide dihydrate dihydrochloride

Systemtic Name: 2-(4-aminophenyl)-N-methyl-N-[1-(3-oxidanylpyrrolidin-1-yl)-2-phenyl-ethyl]ethanamide dihydrate dihydrochloride Openeye Name: 2-(4-aminophenyl)-N-[1-(3-hydroxypyrrolidin-1-yl)-2-phenyl-ethyl]-N-methyl-acetamide dihydrate dihydrochloride CAS Name: 2-(4-aminophenyl)-N-[1-(3-hydroxy-1-pyrrolidinyl)-2-phenylethyl]-N-methylacetamide dihydrate dihydrochloride IUPAC Name: 2-(4-aminophenyl)-N-[1-(3-hydroxypyrrolidin-1-yl)-2-phenylethyl]-N-methylacetamide dihydrate dihydrochloride Traditional Name: 2-(4-aminophenyl)-N-[1-(3-hydroxypyrrolidino)-2-phenyl-ethyl]-N-methyl-acetamide dihydrate dihydrochloride Formula: C21H33Cl2N3O4 MolecularWeight: 462.41042

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC1=CC=CC=C1)N2CCC(C2)O)C(=O)CC3=CC=C(C=C3)N.O.O.Cl.Cl

Isomeric SMILES

CN(C(CC1=CC=CC=C1)N2CCC(C2)O)C(=O)CC3=CC=C(C=C3)N.O.O.Cl.Cl

InChI

InChI=1S/C21H27N3O2.2ClH.2H2O/c1-23(21(26)14-17-7-9-18(22)10-8-17)20(24-12-11-19(25)15-24)13-16-5-3-2-4-6-16;;;;/h2-10,19-20,25H,11-15,22H2,1H3;2*1H;2*1H2