3-[(3,4-dimethylphenyl)sulfonylamino]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-4-fluoranyl-benzoic acid Openeye Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-4-fluoro-benzoic acid CAS Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-4-fluorobenzoic acid IUPAC Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-4-fluorobenzoic acid Traditional Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-4-fluoro-benzoic acid Formula: C15H14FNO4S MolecularWeight: 323.339363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)O)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)O)F)C

InChI

InChI=1S/C15H14FNO4S/c1-9-3-5-12(7-10(9)2)22(20,21)17-14-8-11(15(18)19)4-6-13(14)16/h3-8,17H,1-2H3,(H,18,19)