methyl 4-methyl-5-pentyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-methyl-5-pentyl-thiophene-2-carboxylate Openeye Name: methyl 4-methyl-5-pentyl-thiophene-2-carboxylate CAS Name: 4-methyl-5-pentyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-5-pentylthiophene-2-carboxylate Traditional Name: 5-amyl-4-methyl-thiophene-2-carboxylic acid methyl ester Formula: C12H18O2S MolecularWeight: 226.33512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C(S1)C(=O)OC)C

Isomeric SMILES

CCCCCC1=C(C=C(S1)C(=O)OC)C

InChI

InChI=1S/C12H18O2S/c1-4-5-6-7-10-9(2)8-11(15-10)12(13)14-3/h8H,4-7H2,1-3H3