4-methoxy-3-nitro-N-(2-oxidanylidenethiolan-3-yl)benzamide

Systemtic Name: 4-methoxy-3-nitro-N-(2-oxidanylidenethiolan-3-yl)benzamide Openeye Name: 4-methoxy-3-nitro-N-(2-oxotetrahydrothiophen-3-yl)benzamide CAS Name: 4-methoxy-3-nitro-N-(2-oxo-3-thiolanyl)benzamide IUPAC Name: 4-methoxy-3-nitro-N-(2-oxothiolan-3-yl)benzamide Traditional Name: N-(2-ketotetrahydrothiophen-3-yl)-4-methoxy-3-nitro-benzamide Formula: C12H12N2O5S MolecularWeight: 296.29908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2CCSC2=O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2CCSC2=O)[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O5S/c1-19-10-3-2-7(6-9(10)14(17)18)11(15)13-8-4-5-20-12(8)16/h2-3,6,8H,4-5H2,1H3,(H,13,15)