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

Systemtic Name: N-butyl-4-[(Z)-1-(3-fluoranyl-4-methyl-phenyl)-2-(hydroxymethyl)-4-oxidanyl-but-1-enyl]benzenesulfonamide Openeye Name: N-butyl-4-[(Z)-1-(3-fluoro-4-methyl-phenyl)-4-hydroxy-2-(hydroxymethyl)but-1-enyl]benzenesulfonamide CAS Name: N-butyl-4-[(Z)-1-(3-fluoro-4-methylphenyl)-4-hydroxy-2-(hydroxymethyl)but-1-enyl]benzenesulfonamide IUPAC Name: N-butyl-4-[(Z)-1-(3-fluoro-4-methylphenyl)-4-hydroxy-2-(hydroxymethyl)but-1-enyl]benzenesulfonamide Traditional Name: N-butyl-4-[(Z)-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:

CCCCNS(=O)(=O)C1=CC=C(C=C1)C(=C(CCO)CO)C2=CC(=C(C=C2)C)F

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC=C(C=C1)/C(=C(\CCO)/CO)/C2=CC(=C(C=C2)C)F

InChI

InChI=1S/C22H28FNO4S/c1-3-4-12-24-29(27,28)20-9-7-17(8-10-20)22(19(15-26)11-13-25)18-6-5-16(2)21(23)14-18/h5-10,14,24-26H,3-4,11-13,15H2,1-2H3/b22-19-