ethyl 2-methyl-4-oxidanyl-5-pentyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-methyl-4-oxidanyl-5-pentyl-thiophene-3-carboxylate Openeye Name: ethyl 4-hydroxy-2-methyl-5-pentyl-thiophene-3-carboxylate CAS Name: 4-hydroxy-2-methyl-5-pentyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-2-methyl-5-pentylthiophene-3-carboxylate Traditional Name: 5-amyl-4-hydroxy-2-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C13H20O3S MolecularWeight: 256.3611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(S1)C)C(=O)OCC)O

Isomeric SMILES

CCCCCC1=C(C(=C(S1)C)C(=O)OCC)O

InChI

InChI=1S/C13H20O3S/c1-4-6-7-8-10-12(14)11(9(3)17-10)13(15)16-5-2/h14H,4-8H2,1-3H3