N-ethyl-N-[methylsulfonyl(piperidin-4-yl)methyl]-1-[3-(trifluoromethyl)phenyl]propan-2-amine hydrochloride

Systemtic Name: N-ethyl-N-[methylsulfonyl(piperidin-4-yl)methyl]-1-[3-(trifluoromethyl)phenyl]propan-2-amine hydrochloride Openeye Name: N-ethyl-N-[methylsulfonyl(4-piperidyl)methyl]-1-[3-(trifluoromethyl)phenyl]propan-2-amine hydrochloride CAS Name: N-ethyl-N-[methylsulfonyl(4-piperidinyl)methyl]-1-[3-(trifluoromethyl)phenyl]-2-propanamine hydrochloride IUPAC Name: N-ethyl-N-[methylsulfonyl(piperidin-4-yl)methyl]-1-[3-(trifluoromethyl)phenyl]propan-2-amine hydrochloride Traditional Name: ethyl-[mesyl(4-piperidyl)methyl]-[1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl]amine hydrochloride Formula: C19H30ClF3N2O2S MolecularWeight: 442.96691

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(C)CC1=CC(=CC=C1)C(F)(F)F)C(C2CCNCC2)S(=O)(=O)C.Cl

Isomeric SMILES

CCN(C(C)CC1=CC(=CC=C1)C(F)(F)F)C(C2CCNCC2)S(=O)(=O)C.Cl

InChI

InChI=1S/C19H29F3N2O2S.ClH/c1-4-24(18(27(3,25)26)16-8-10-23-11-9-16)14(2)12-15-6-5-7-17(13-15)19(20,21)22;/h5-7,13-14,16,18,23H,4,8-12H2,1-3H3;1H