N-tert-butyl-4-[(E)-1-(3-fluoranyl-4-methyl-phenyl)-2-(hydroxymethyl)-4-oxidanyl-but-1-enyl]benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[(E)-1-(3-fluoranyl-4-methyl-phenyl)-2-(hydroxymethyl)-4-oxidanyl-but-1-enyl]benzenesulfonamide Openeye Name: N-tert-butyl-4-[(E)-1-(3-fluoro-4-methyl-phenyl)-4-hydroxy-2-(hydroxymethyl)but-1-enyl]benzenesulfonamide CAS Name: N-tert-butyl-4-[(E)-1-(3-fluoro-4-methylphenyl)-4-hydroxy-2-(hydroxymethyl)but-1-enyl]benzenesulfonamide IUPAC Name: N-tert-butyl-4-[(E)-1-(3-fluoro-4-methylphenyl)-4-hydroxy-2-(hydroxymethyl)but-1-enyl]benzenesulfonamide Traditional Name: N-tert-butyl-4-[(E)-1-(3-fluoro-4-methyl-phenyl)-4-hydroxy-2-methylol-but-1-enyl]benzenesulfonamide Formula: C22H28FNO4S MolecularWeight: 421.525423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=C(CCO)CO)C2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)/C(=C(\CCO)/CO)/C2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)F

InChI

InChI=1S/C22H28FNO4S/c1-15-5-6-17(13-20(15)23)21(18(14-26)11-12-25)16-7-9-19(10-8-16)29(27,28)24-22(2,3)4/h5-10,13,24-26H,11-12,14H2,1-4H3/b21-18+