3-[4-(trifluoromethylsulfonyl)piperazin-1-yl]aniline

Systemtic Name: 3-[4-(trifluoromethylsulfonyl)piperazin-1-yl]aniline Openeye Name: 3-[4-(trifluoromethylsulfonyl)piperazin-1-yl]aniline CAS Name: 3-[4-(trifluoromethylsulfonyl)-1-piperazinyl]aniline IUPAC Name: 3-[4-(trifluoromethylsulfonyl)piperazin-1-yl]aniline Traditional Name: [3-(4-triflylpiperazino)phenyl]amine Formula: C11H14F3N3O2S MolecularWeight: 309.30797

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)N)S(=O)(=O)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)N)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C11H14F3N3O2S/c12-11(13,14)20(18,19)17-6-4-16(5-7-17)10-3-1-2-9(15)8-10/h1-3,8H,4-7,15H2