2,6-bis(fluoranyl)-3-(2-methylmorpholin-4-yl)sulfonyl-benzoic acid

Systemtic Name: 2,6-bis(fluoranyl)-3-(2-methylmorpholin-4-yl)sulfonyl-benzoic acid Openeye Name: 2,6-difluoro-3-(2-methylmorpholin-4-yl)sulfonyl-benzoic acid CAS Name: 2,6-difluoro-3-[(2-methyl-4-morpholinyl)sulfonyl]benzoic acid IUPAC Name: 2,6-difluoro-3-(2-methylmorpholin-4-yl)sulfonylbenzoic acid Traditional Name: 2,6-difluoro-3-(2-methylmorpholino)sulfonyl-benzoic acid Formula: C12H13F2NO5S MolecularWeight: 321.297126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)S(=O)(=O)C2=C(C(=C(C=C2)F)C(=O)O)F

Isomeric SMILES

CC1CN(CCO1)S(=O)(=O)C2=C(C(=C(C=C2)F)C(=O)O)F

InChI

InChI=1S/C12H13F2NO5S/c1-7-6-15(4-5-20-7)21(18,19)9-3-2-8(13)10(11(9)14)12(16)17/h2-3,7H,4-6H2,1H3,(H,16,17)