[(6-methyl-2,3-dihydro-1,4-oxathiin-5-yl)carbonylamino] 2,4-bis(fluoranyl)benzoate

Systemtic Name: [(6-methyl-2,3-dihydro-1,4-oxathiin-5-yl)carbonylamino] 2,4-bis(fluoranyl)benzoate Openeye Name: [(6-methyl-2,3-dihydro-1,4-oxathiine-5-carbonyl)amino] 2,4-difluorobenzoate CAS Name: 2,4-difluorobenzoic acid [[(6-methyl-2,3-dihydro-1,4-oxathiin-5-yl)-oxomethyl]amino] ester IUPAC Name: [(6-methyl-2,3-dihydro-1,4-oxathiine-5-carbonyl)amino] 2,4-difluorobenzoate Traditional Name: 2,4-difluorobenzoic acid [(6-methyl-2,3-dihydro-1,4-oxathiin-5-carbonyl)amino] ester Formula: C13H11F2NO4S MolecularWeight: 315.292546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SCCO1)C(=O)NOC(=O)C2=C(C=C(C=C2)F)F

Isomeric SMILES

CC1=C(SCCO1)C(=O)NOC(=O)C2=C(C=C(C=C2)F)F

InChI

InChI=1S/C13H11F2NO4S/c1-7-11(21-5-4-19-7)12(17)16-20-13(18)9-3-2-8(14)6-10(9)15/h2-3,6H,4-5H2,1H3,(H,16,17)