methyl 2-(3-nitro-5-sulfamoyl-thiophen-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(3-nitro-5-sulfamoyl-thiophen-2-yl)sulfanylethanoate Openeye Name: methyl 2-[(3-nitro-5-sulfamoyl-2-thienyl)sulfanyl]acetate CAS Name: 2-[(3-nitro-5-sulfamoyl-2-thiophenyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(3-nitro-5-sulfamoylthiophen-2-yl)sulfanylacetate Traditional Name: 2-[(3-nitro-5-sulfamoyl-2-thienyl)thio]acetic acid methyl ester Formula: C7H8N2O6S3 MolecularWeight: 312.34322

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C(C=C(S1)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CSC1=C(C=C(S1)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C7H8N2O6S3/c1-15-5(10)3-16-7-4(9(11)12)2-6(17-7)18(8,13)14/h2H,3H2,1H3,(H2,8,13,14)