3-[[6-fluoranyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]amino]propanoic acid

Systemtic Name: 3-[[6-fluoranyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]amino]propanoic acid Openeye Name: 3-[(6-fluoro-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)amino]propanoic acid CAS Name: 3-[(6-fluoro-1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]propanoic acid IUPAC Name: 3-[(6-fluoro-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)amino]propanoic acid Traditional Name: 3-[(6-fluoro-1,1-diketo-3,4-dihydro-2H-thiochromen-4-yl)amino]propionic acid Formula: C12H14FNO4S MolecularWeight: 287.307263

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)C2=C(C1NCCC(=O)O)C=C(C=C2)F

Isomeric SMILES

C1CS(=O)(=O)C2=C(C1NCCC(=O)O)C=C(C=C2)F

InChI

InChI=1S/C12H14FNO4S/c13-8-1-2-11-9(7-8)10(4-6-19(11,17)18)14-5-3-12(15)16/h1-2,7,10,14H,3-6H2,(H,15,16)