2-(4-bromophenyl)sulfinyloctanoic acid

Systemtic Name: 2-(4-bromophenyl)sulfinyloctanoic acid Openeye Name: 2-(4-bromophenyl)sulfinyloctanoic acid CAS Name: 2-(4-bromophenyl)sulfinyloctanoic acid IUPAC Name: 2-(4-bromophenyl)sulfinyloctanoic acid Traditional Name: 2-(4-bromophenyl)sulfinylcaprylic acid Formula: C14H19BrO3S MolecularWeight: 347.26786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19BrO3S/c1-2-3-4-5-6-13(14(16)17)19(18)12-9-7-11(15)8-10-12/h7-10,13H,2-6H2,1H3,(H,16,17)