5-[[3,5-bis(methoxycarbonyl)-4-methyl-thiophen-2-yl]sulfonylamino]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[[3,5-bis(methoxycarbonyl)-4-methyl-thiophen-2-yl]sulfonylamino]-2-fluoranyl-benzoic acid Openeye Name: 5-[[3,5-bis(methoxycarbonyl)-4-methyl-2-thienyl]sulfonylamino]-2-fluoro-benzoic acid CAS Name: 5-[[3,5-bis(methoxycarbonyl)-4-methyl-2-thiophenyl]sulfonylamino]-2-fluorobenzoic acid IUPAC Name: 5-[[3,5-bis(methoxycarbonyl)-4-methylthiophen-2-yl]sulfonylamino]-2-fluorobenzoic acid Traditional Name: 5-[(3,5-dicarbomethoxy-4-methyl-2-thienyl)sulfonylamino]-2-fluoro-benzoic acid Formula: C16H14FNO8S2 MolecularWeight: 431.412663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)S(=O)(=O)NC2=CC(=C(C=C2)F)C(=O)O)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)S(=O)(=O)NC2=CC(=C(C=C2)F)C(=O)O)C(=O)OC

InChI

InChI=1S/C16H14FNO8S2/c1-7-11(14(21)25-2)16(27-12(7)15(22)26-3)28(23,24)18-8-4-5-10(17)9(6-8)13(19)20/h4-6,18H,1-3H3,(H,19,20)