dimethyl 2-(1-nitro-2-oxidanylidene-ethylidene)-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-(1-nitro-2-oxidanylidene-ethylidene)-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-(1-nitro-2-oxo-ethylidene)-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-(1-nitro-2-oxoethylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(1-nitro-2-oxoethylidene)-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-(2-keto-1-nitro-ethylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C9H7NO7S2 MolecularWeight: 305.28438

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C(C=O)[N+](=O)[O-])S1)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SC(=C(C=O)[N+](=O)[O-])S1)C(=O)OC

InChI

InChI=1S/C9H7NO7S2/c1-16-7(12)5-6(8(13)17-2)19-9(18-5)4(3-11)10(14)15/h3H,1-2H3