5-[[(2E,4E)-hexa-2,4-dienoyl]amino]-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[[(2E,4E)-hexa-2,4-dienoyl]amino]-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[[(2E,4E)-hexa-2,4-dienoyl]amino]-3-methyl-thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[[(2E,4E)-1-oxohexa-2,4-dienyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[[(2E,4E)-hexa-2,4-dienoyl]amino]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-[[(2E,4E)-hexa-2,4-dienoyl]amino]-3-methyl-2-thenoic acid Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)NC1=CC(=C(S1)C(=O)O)C

Isomeric SMILES

C/C=C/C=C/C(=O)NC1=CC(=C(S1)C(=O)O)C

InChI

InChI=1S/C12H13NO3S/c1-3-4-5-6-9(14)13-10-7-8(2)11(17-10)12(15)16/h3-7H,1-2H3,(H,13,14)(H,15,16)/b4-3+,6-5+