2-(octanoylamino)thiophene-3-carboxylic acid

Systemtic Name: 2-(octanoylamino)thiophene-3-carboxylic acid Openeye Name: 2-(octanoylamino)thiophene-3-carboxylic acid CAS Name: 2-(1-oxooctylamino)-3-thiophenecarboxylic acid IUPAC Name: 2-(octanoylamino)thiophene-3-carboxylic acid Traditional Name: 2-(caprylylamino)-3-thenoic acid Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=C(C=CS1)C(=O)O

Isomeric SMILES

CCCCCCCC(=O)NC1=C(C=CS1)C(=O)O

InChI

InChI=1S/C13H19NO3S/c1-2-3-4-5-6-7-11(15)14-12-10(13(16)17)8-9-18-12/h8-9H,2-7H2,1H3,(H,14,15)(H,16,17)