5-(azepan-1-ylsulfonyl)-2-methyl-benzoic acid

Molecular Formula: C₁₄H₁₉NO₄S

InChI: InChI=1/C14H19NO4S/c1-11-6-7-12(10-13(11)14(16)17)20(18,19)15-8-4-2-3-5-9-15/h6-7,10H,2-5,8-9H2,1H3,(H,16,17)/f/h16H

InChIKey: InChIKey=VAOLXVJIDKIWKA-WYUMXYHSCF
SMILES: CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)O

Names:
    5-(azepan-1-ylsulfonyl)-2-methyl-benzoic acid

Registries:
    PubChem CID 1522469
    PubChem ID 6063310