3-(fluoranylmethyl)-7-[3,3,3-tris(fluoranyl)propylsulfonyl]-1,2,3,4-tetrahydroisoquinoline hydrochloride

Systemtic Name: 3-(fluoranylmethyl)-7-[3,3,3-tris(fluoranyl)propylsulfonyl]-1,2,3,4-tetrahydroisoquinoline hydrochloride Openeye Name: 3-(fluoromethyl)-7-(3,3,3-trifluoropropylsulfonyl)-1,2,3,4-tetrahydroisoquinoline hydrochloride CAS Name: 3-(fluoromethyl)-7-(3,3,3-trifluoropropylsulfonyl)-1,2,3,4-tetrahydroisoquinoline hydrochloride IUPAC Name: 3-(fluoromethyl)-7-(3,3,3-trifluoropropylsulfonyl)-1,2,3,4-tetrahydroisoquinoline hydrochloride Traditional Name: 3-(fluoromethyl)-7-(3,3,3-trifluoropropylsulfonyl)-1,2,3,4-tetrahydroisoquinoline hydrochloride Formula: C13H16ClF4NO2S MolecularWeight: 361.783253

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=C1C=CC(=C2)S(=O)(=O)CCC(F)(F)F)CF.Cl

Isomeric SMILES

C1C(NCC2=C1C=CC(=C2)S(=O)(=O)CCC(F)(F)F)CF.Cl

InChI

InChI=1S/C13H15F4NO2S.ClH/c14-7-11-5-9-1-2-12(6-10(9)8-18-11)21(19,20)4-3-13(15,16)17;/h1-2,6,11,18H,3-5,7-8H2;1H