1-(4-pentan-3-ylpiperazin-1-yl)-2-[3-(trifluoromethyl)phenyl]ethanone hydrochloride

Systemtic Name: 1-(4-pentan-3-ylpiperazin-1-yl)-2-[3-(trifluoromethyl)phenyl]ethanone hydrochloride Openeye Name: 1-[4-(1-ethylpropyl)piperazin-1-yl]-2-[3-(trifluoromethyl)phenyl]ethanone hydrochloride CAS Name: 1-(4-pentan-3-yl-1-piperazinyl)-2-[3-(trifluoromethyl)phenyl]ethanone hydrochloride IUPAC Name: 1-(4-pentan-3-ylpiperazin-1-yl)-2-[3-(trifluoromethyl)phenyl]ethanone hydrochloride Traditional Name: 1-[4-(1-ethylpropyl)piperazino]-2-[3-(trifluoromethyl)phenyl]ethanone hydrochloride Formula: C18H26ClF3N2O MolecularWeight: 378.86005

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCN(CC1)C(=O)CC2=CC(=CC=C2)C(F)(F)F.Cl

Isomeric SMILES

CCC(CC)N1CCN(CC1)C(=O)CC2=CC(=CC=C2)C(F)(F)F.Cl

InChI

InChI=1S/C18H25F3N2O.ClH/c1-3-16(4-2)22-8-10-23(11-9-22)17(24)13-14-6-5-7-15(12-14)18(19,20)21;/h5-7,12,16H,3-4,8-11,13H2,1-2H3;1H