1-[4-ethanoyl-2-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone hydrochloride

Systemtic Name: 1-[4-ethanoyl-2-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone hydrochloride Openeye Name: 1-[4-acetyl-2-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone hydrochloride CAS Name: 1-[4-acetyl-2-[[2-(hydroxymethyl)-1-pyrrolidinyl]methyl]-1-piperazinyl]-2-[4-(trifluoromethyl)phenyl]ethanone hydrochloride IUPAC Name: 1-[4-acetyl-2-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone hydrochloride Traditional Name: 1-[4-acetyl-2-[(2-methylolpyrrolidino)methyl]piperazino]-2-[4-(trifluoromethyl)phenyl]ethanone hydrochloride Formula: C21H29ClF3N3O3 MolecularWeight: 463.92147

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(C(C1)CN2CCCC2CO)C(=O)CC3=CC=C(C=C3)C(F)(F)F.Cl

Isomeric SMILES

CC(=O)N1CCN(C(C1)CN2CCCC2CO)C(=O)CC3=CC=C(C=C3)C(F)(F)F.Cl

InChI

InChI=1S/C21H28F3N3O3.ClH/c1-15(29)25-9-10-27(19(12-25)13-26-8-2-3-18(26)14-28)20(30)11-16-4-6-17(7-5-16)21(22,23)24;/h4-7,18-19,28H,2-3,8-14H2,1H3;1H