3-methyl-5-(2-methylpropanoylamino)thiophene-2,4-dicarboxylic acid

Systemtic Name: 3-methyl-5-(2-methylpropanoylamino)thiophene-2,4-dicarboxylic acid Openeye Name: 3-methyl-5-(2-methylpropanoylamino)thiophene-2,4-dicarboxylic acid CAS Name: 3-methyl-5-[(2-methyl-1-oxopropyl)amino]thiophene-2,4-dicarboxylic acid IUPAC Name: 3-methyl-5-(2-methylpropanoylamino)thiophene-2,4-dicarboxylic acid Traditional Name: 5-(isobutyrylamino)-3-methyl-thiophene-2,4-dicarboxylic acid Formula: C11H13NO5S MolecularWeight: 271.28962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)NC(=O)C(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)NC(=O)C(C)C)C(=O)O

InChI

InChI=1S/C11H13NO5S/c1-4(2)8(13)12-9-6(10(14)15)5(3)7(18-9)11(16)17/h4H,1-3H3,(H,12,13)(H,14,15)(H,16,17)