N-methyl-N-phenyl-4-[(E)-4,4,4-tris(fluoranyl)-3-methyl-3-oxidanyl-but-1-enyl]benzenesulfonamide

Systemtic Name: N-methyl-N-phenyl-4-[(E)-4,4,4-tris(fluoranyl)-3-methyl-3-oxidanyl-but-1-enyl]benzenesulfonamide Openeye Name: N-methyl-N-phenyl-4-[(E)-4,4,4-trifluoro-3-hydroxy-3-methyl-but-1-enyl]benzenesulfonamide CAS Name: N-methyl-N-phenyl-4-[(E)-4,4,4-trifluoro-3-hydroxy-3-methylbut-1-enyl]benzenesulfonamide IUPAC Name: N-methyl-N-phenyl-4-[(E)-4,4,4-trifluoro-3-hydroxy-3-methylbut-1-enyl]benzenesulfonamide Traditional Name: N-methyl-N-phenyl-4-[(E)-4,4,4-trifluoro-3-hydroxy-3-methyl-but-1-enyl]benzenesulfonamide Formula: C18H18F3NO3S MolecularWeight: 385.40063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2)(C(F)(F)F)O

Isomeric SMILES

CC(/C=C/C1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2)(C(F)(F)F)O

InChI

InChI=1S/C18H18F3NO3S/c1-17(23,18(19,20)21)13-12-14-8-10-16(11-9-14)26(24,25)22(2)15-6-4-3-5-7-15/h3-13,23H,1-2H3/b13-12+