4-(4-but-2-ynoxyphenyl)sulfonyl-N-oxidanyl-1-(trifluoromethylsulfonyl)piperidine-4-carboxamide

Systemtic Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-N-oxidanyl-1-(trifluoromethylsulfonyl)piperidine-4-carboxamide Openeye Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-1-(trifluoromethylsulfonyl)piperidine-4-carbohydroxamic acid CAS Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-1-(trifluoromethylsulfonyl)-4-piperidinecarboxamide IUPAC Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-1-(trifluoromethylsulfonyl)piperidine-4-carboxamide Traditional Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-1-triflyl-piperidine-4-carbohydroxamic acid Formula: C17H19F3N2O7S2 MolecularWeight: 484.46717

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C2(CCN(CC2)S(=O)(=O)C(F)(F)F)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C2(CCN(CC2)S(=O)(=O)C(F)(F)F)C(=O)NO

InChI

InChI=1S/C17H19F3N2O7S2/c1-2-3-12-29-13-4-6-14(7-5-13)30(25,26)16(15(23)21-24)8-10-22(11-9-16)31(27,28)17(18,19)20/h4-7,24H,8-12H2,1H3,(H,21,23)