4-(4-bromophenyl)-N-(1-oxidanyl-6-phenoxy-hex-4-yn-2-yl)benzenesulfonamide

Systemtic Name: 4-(4-bromophenyl)-N-(1-oxidanyl-6-phenoxy-hex-4-yn-2-yl)benzenesulfonamide Openeye Name: 4-(4-bromophenyl)-N-[1-(hydroxymethyl)-5-phenoxy-pent-3-ynyl]benzenesulfonamide CAS Name: 4-(4-bromophenyl)-N-(1-hydroxy-6-phenoxyhex-4-yn-2-yl)benzenesulfonamide IUPAC Name: 4-(4-bromophenyl)-N-(1-hydroxy-6-phenoxyhex-4-yn-2-yl)benzenesulfonamide Traditional Name: 4-(4-bromophenyl)-N-(1-methylol-5-phenoxy-pent-3-ynyl)benzenesulfonamide Formula: C24H22BrNO4S MolecularWeight: 500.40478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC#CCC(CO)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)OCC#CCC(CO)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C24H22BrNO4S/c25-21-13-9-19(10-14-21)20-11-15-24(16-12-20)31(28,29)26-22(18-27)6-4-5-17-30-23-7-2-1-3-8-23/h1-3,7-16,22,26-27H,6,17-18H2