5-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylsulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylsulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylsulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[2-(4,5-dimethoxy-2-nitrophenyl)ethylsulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[2-(4,5-dimethoxy-2-nitrophenyl)ethylsulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylsulfamoyl]-3-thenoic acid Formula: C15H16N2O8S2 MolecularWeight: 416.42614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNS(=O)(=O)C2=CC(=CS2)C(=O)O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNS(=O)(=O)C2=CC(=CS2)C(=O)O)[N+](=O)[O-])OC

InChI

InChI=1S/C15H16N2O8S2/c1-24-12-5-9(11(17(20)21)7-13(12)25-2)3-4-16-27(22,23)14-6-10(8-26-14)15(18)19/h5-8,16H,3-4H2,1-2H3,(H,18,19)