ethyl 2-(4-nitro-2-sulfamoyl-phenyl)sulfanylethanoate

Systemtic Name: ethyl 2-(4-nitro-2-sulfamoyl-phenyl)sulfanylethanoate Openeye Name: ethyl 2-(4-nitro-2-sulfamoyl-phenyl)sulfanylacetate CAS Name: 2-[(4-nitro-2-sulfamoylphenyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(4-nitro-2-sulfamoylphenyl)sulfanylacetate Traditional Name: 2-[(4-nitro-2-sulfamoyl-phenyl)thio]acetic acid ethyl ester Formula: C10H12N2O6S2 MolecularWeight: 320.34208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

CCOC(=O)CSC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C10H12N2O6S2/c1-2-18-10(13)6-19-8-4-3-7(12(14)15)5-9(8)20(11,16)17/h3-5H,2,6H2,1H3,(H2,11,16,17)