3-(3,3-dimethylbutanoylamino)thiophene-2-carboxylic acid

Systemtic Name: 3-(3,3-dimethylbutanoylamino)thiophene-2-carboxylic acid Openeye Name: 3-(3,3-dimethylbutanoylamino)thiophene-2-carboxylic acid CAS Name: 3-[(3,3-dimethyl-1-oxobutyl)amino]-2-thiophenecarboxylic acid IUPAC Name: 3-(3,3-dimethylbutanoylamino)thiophene-2-carboxylic acid Traditional Name: 3-(3,3-dimethylbutanoylamino)-2-thenoic acid Formula: C11H15NO3S MolecularWeight: 241.3067

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=C(SC=C1)C(=O)O

Isomeric SMILES

CC(C)(C)CC(=O)NC1=C(SC=C1)C(=O)O

InChI

InChI=1S/C11H15NO3S/c1-11(2,3)6-8(13)12-7-4-5-16-9(7)10(14)15/h4-5H,6H2,1-3H3,(H,12,13)(H,14,15)