3-(2-ethylhexanoylamino)thiophene-2-carboxylic acid

Systemtic Name: 3-(2-ethylhexanoylamino)thiophene-2-carboxylic acid Openeye Name: 3-(2-ethylhexanoylamino)thiophene-2-carboxylic acid CAS Name: 3-[(2-ethyl-1-oxohexyl)amino]-2-thiophenecarboxylic acid IUPAC Name: 3-(2-ethylhexanoylamino)thiophene-2-carboxylic acid Traditional Name: 3-(2-ethylhexanoylamino)-2-thenoic acid Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO3S/c1-3-5-6-9(4-2)12(15)14-10-7-8-18-11(10)13(16)17/h7-9H,3-6H2,1-2H3,(H,14,15)(H,16,17)