4,5-dimethyl-2-(octanoylamino)thiophene-3-carboxylic acid

Systemtic Name: 4,5-dimethyl-2-(octanoylamino)thiophene-3-carboxylic acid Openeye Name: 4,5-dimethyl-2-(octanoylamino)thiophene-3-carboxylic acid CAS Name: 4,5-dimethyl-2-(1-oxooctylamino)-3-thiophenecarboxylic acid IUPAC Name: 4,5-dimethyl-2-(octanoylamino)thiophene-3-carboxylic acid Traditional Name: 2-(caprylylamino)-4,5-dimethyl-3-thenoic acid Formula: C15H23NO3S MolecularWeight: 297.41302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=C(C(=C(S1)C)C)C(=O)O

Isomeric SMILES

CCCCCCCC(=O)NC1=C(C(=C(S1)C)C)C(=O)O

InChI

InChI=1S/C15H23NO3S/c1-4-5-6-7-8-9-12(17)16-14-13(15(18)19)10(2)11(3)20-14/h4-9H2,1-3H3,(H,16,17)(H,18,19)