2-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]ethanoylamino]-6-fluoranyl-benzoic acid

Systemtic Name: 2-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]ethanoylamino]-6-fluoranyl-benzoic acid Openeye Name: 2-[[2-(1,1-dioxothiolan-3-yl)acetyl]amino]-6-fluoro-benzoic acid CAS Name: 2-[[2-(1,1-dioxo-3-thiolanyl)-1-oxoethyl]amino]-6-fluorobenzoic acid IUPAC Name: 2-[[2-(1,1-dioxothiolan-3-yl)acetyl]amino]-6-fluorobenzoic acid Traditional Name: 2-[[2-(1,1-diketothiolan-3-yl)acetyl]amino]-6-fluoro-benzoic acid Formula: C13H14FNO5S MolecularWeight: 315.317363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1CC(=O)NC2=C(C(=CC=C2)F)C(=O)O

Isomeric SMILES

C1CS(=O)(=O)CC1CC(=O)NC2=C(C(=CC=C2)F)C(=O)O

InChI

InChI=1S/C13H14FNO5S/c14-9-2-1-3-10(12(9)13(17)18)15-11(16)6-8-4-5-21(19,20)7-8/h1-3,8H,4-7H2,(H,15,16)(H,17,18)