5-octylthiophene-2-carboxylic acid

Systemtic Name: 5-octylthiophene-2-carboxylic acid Openeye Name: 5-octylthiophene-2-carboxylic acid CAS Name: 5-octyl-2-thiophenecarboxylic acid IUPAC Name: 5-octylthiophene-2-carboxylic acid Traditional Name: 5-octyl-2-thenoic acid Formula: C13H20O2S MolecularWeight: 240.3617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(S1)C(=O)O

Isomeric SMILES

CCCCCCCCC1=CC=C(S1)C(=O)O

InChI

InChI=1S/C13H20O2S/c1-2-3-4-5-6-7-8-11-9-10-12(16-11)13(14)15/h9-10H,2-8H2,1H3,(H,14,15)