2,5-dimethyl-4-(3-methylbutylsulfamoyl)furan-3-carboxylic acid

Systemtic Name: 2,5-dimethyl-4-(3-methylbutylsulfamoyl)furan-3-carboxylic acid Openeye Name: 4-(isopentylsulfamoyl)-2,5-dimethyl-furan-3-carboxylic acid CAS Name: 2,5-dimethyl-4-(3-methylbutylsulfamoyl)-3-furancarboxylic acid IUPAC Name: 2,5-dimethyl-4-(3-methylbutylsulfamoyl)furan-3-carboxylic acid Traditional Name: 4-(isoamylsulfamoyl)-2,5-dimethyl-3-furoic acid Formula: C12H19NO5S MolecularWeight: 289.34796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)C)S(=O)(=O)NCCC(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=C(O1)C)S(=O)(=O)NCCC(C)C)C(=O)O

InChI

InChI=1S/C12H19NO5S/c1-7(2)5-6-13-19(16,17)11-9(4)18-8(3)10(11)12(14)15/h7,13H,5-6H2,1-4H3,(H,14,15)