4-[4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)butoxy]benzenesulfonamide

Systemtic Name: 4-[4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)butoxy]benzenesulfonamide Openeye Name: 4-[4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)butoxy]benzenesulfonamide CAS Name: 4-[4-(4-acetyl-3-hydroxy-2-propylphenoxy)butoxy]benzenesulfonamide IUPAC Name: 4-[4-(4-acetyl-3-hydroxy-2-propylphenoxy)butoxy]benzenesulfonamide Traditional Name: 4-[4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)butoxy]benzenesulfonamide Formula: C21H27NO6S MolecularWeight: 421.50718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCOC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCOC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C21H27NO6S/c1-3-6-19-20(12-11-18(15(2)23)21(19)24)28-14-5-4-13-27-16-7-9-17(10-8-16)29(22,25)26/h7-12,24H,3-6,13-14H2,1-2H3,(H2,22,25,26)