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

Systemtic Name: [(6-methyl-2,3-dihydro-1,4-oxathiin-5-yl)carbonylamino] 4-fluoranylbenzoate Openeye Name: [(6-methyl-2,3-dihydro-1,4-oxathiine-5-carbonyl)amino] 4-fluorobenzoate CAS Name: 4-fluorobenzoic 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] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [(6-methyl-2,3-dihydro-1,4-oxathiin-5-carbonyl)amino] ester Formula: C13H12FNO4S MolecularWeight: 297.302083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12FNO4S/c1-8-11(20-7-6-18-8)12(16)15-19-13(17)9-2-4-10(14)5-3-9/h2-5H,6-7H2,1H3,(H,15,16)