3-[[3,5-bis(fluoranyl)phenyl]sulfonylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[[3,5-bis(fluoranyl)phenyl]sulfonylamino]-4-methyl-benzoic acid Openeye Name: 3-[(3,5-difluorophenyl)sulfonylamino]-4-methyl-benzoic acid CAS Name: 3-[(3,5-difluorophenyl)sulfonylamino]-4-methylbenzoic acid IUPAC Name: 3-[(3,5-difluorophenyl)sulfonylamino]-4-methylbenzoic acid Traditional Name: 3-[(3,5-difluorophenyl)sulfonylamino]-4-methyl-benzoic acid Formula: C14H11F2NO4S MolecularWeight: 327.303246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NS(=O)(=O)C2=CC(=CC(=C2)F)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NS(=O)(=O)C2=CC(=CC(=C2)F)F

InChI

InChI=1S/C14H11F2NO4S/c1-8-2-3-9(14(18)19)4-13(8)17-22(20,21)12-6-10(15)5-11(16)7-12/h2-7,17H,1H3,(H,18,19)