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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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