5-[3-(furan-2-yl)propanoylamino]-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[3-(furan-2-yl)propanoylamino]-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[3-(2-furyl)propanoylamino]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[[3-(2-furanyl)-1-oxopropyl]amino]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[3-(furan-2-yl)propanoylamino]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-[3-(2-furyl)propanoylamino]-3-methyl-2-thenoic acid Formula: C13H13NO4S MolecularWeight: 279.31162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)CCC2=CC=CO2)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)CCC2=CC=CO2)C(=O)O

InChI

InChI=1S/C13H13NO4S/c1-8-7-11(19-12(8)13(16)17)14-10(15)5-4-9-3-2-6-18-9/h2-3,6-7H,4-5H2,1H3,(H,14,15)(H,16,17)