8-phenyl-2-(phenylsulfonyl)octanoic acid

Systemtic Name: 8-phenyl-2-(phenylsulfonyl)octanoic acid Openeye Name: 2-(benzenesulfonyl)-8-phenyl-octanoic acid CAS Name: 2-(benzenesulfonyl)-8-phenyloctanoic acid IUPAC Name: 2-(benzenesulfonyl)-8-phenyloctanoic acid Traditional Name: 2-besyl-8-phenyl-caprylic acid Formula: C20H24O4S MolecularWeight: 360.46716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCC(C(=O)O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCC(C(=O)O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H24O4S/c21-20(22)19(25(23,24)18-14-8-4-9-15-18)16-10-2-1-5-11-17-12-6-3-7-13-17/h3-4,6-9,12-15,19H,1-2,5,10-11,16H2,(H,21,22)