1-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2,2-dimethyl-propan-1-one

Systemtic Name: 1-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2,2-dimethyl-propan-1-one Openeye Name: 1-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 1-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-2,2-dimethyl-1-propanone IUPAC Name: 1-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2,2-dimethylpropan-1-one Traditional Name: 1-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazino]-2,2-dimethyl-propan-1-one Formula: C16H20ClF3N2O3S MolecularWeight: 412.85481

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CC(C)(C)C(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C16H20ClF3N2O3S/c1-15(2,3)14(23)21-6-8-22(9-7-21)26(24,25)11-4-5-13(17)12(10-11)16(18,19)20/h4-5,10H,6-9H2,1-3H3