methyl 3-(3,5,5-trimethylhexanoylamino)thiophene-2-carboxylate

Systemtic Name: methyl 3-(3,5,5-trimethylhexanoylamino)thiophene-2-carboxylate Openeye Name: methyl 3-(3,5,5-trimethylhexanoylamino)thiophene-2-carboxylate CAS Name: 3-[(3,5,5-trimethyl-1-oxohexyl)amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-(3,5,5-trimethylhexanoylamino)thiophene-2-carboxylate Traditional Name: 3-(3,5,5-trimethylhexanoylamino)thiophene-2-carboxylic acid methyl ester Formula: C15H23NO3S MolecularWeight: 297.41302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=C(SC=C1)C(=O)OC)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)NC1=C(SC=C1)C(=O)OC)CC(C)(C)C

InChI

InChI=1S/C15H23NO3S/c1-10(9-15(2,3)4)8-12(17)16-11-6-7-20-13(11)14(18)19-5/h6-7,10H,8-9H2,1-5H3,(H,16,17)