methyl 2-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-5-fluoranyl-benzoate

Systemtic Name: methyl 2-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-5-fluoranyl-benzoate Openeye Name: methyl 2-[(1,1-dioxothian-4-yl)amino]-5-fluoro-benzoate CAS Name: 2-[(1,1-dioxo-4-thianyl)amino]-5-fluorobenzoic acid methyl ester IUPAC Name: methyl 2-[(1,1-dioxothian-4-yl)amino]-5-fluorobenzoate Traditional Name: 2-[(1,1-diketothian-4-yl)amino]-5-fluoro-benzoic acid methyl ester Formula: C13H16FNO4S MolecularWeight: 301.333843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)F)NC2CCS(=O)(=O)CC2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)F)NC2CCS(=O)(=O)CC2

InChI

InChI=1S/C13H16FNO4S/c1-19-13(16)11-8-9(14)2-3-12(11)15-10-4-6-20(17,18)7-5-10/h2-3,8,10,15H,4-7H2,1H3