N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-fluoranyl-N-methyl-5-nitro-benzamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-fluoranyl-N-methyl-5-nitro-benzamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-2-fluoro-N-methyl-5-nitro-benzamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-2-fluoro-N-methyl-5-nitrobenzamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-2-fluoro-N-methyl-5-nitrobenzamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-fluoro-N-methyl-5-nitro-benzamide Formula: C12H13FN2O5S MolecularWeight: 316.305423

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])F

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])F

InChI

InChI=1S/C12H13FN2O5S/c1-14(9-4-5-21(19,20)7-9)12(16)10-6-8(15(17)18)2-3-11(10)13/h2-3,6,9H,4-5,7H2,1H3