2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrole-3-carboxylate

Systemtic Name: 2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrole-3-carboxylate Openeye Name: 2,5-dimethyl-1-[2-(2-thienyl)ethyl]pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(2-thiophen-2-ylethyl)-3-pyrrolecarboxylate IUPAC Name: 2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-[2-(2-thienyl)ethyl]pyrrole-3-carboxylate Formula: C13H14NO2S- MolecularWeight: 248.32076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CS2)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CS2)C)C(=O)[O-]

InChI

InChI=1S/C13H15NO2S/c1-9-8-12(13(15)16)10(2)14(9)6-5-11-4-3-7-17-11/h3-4,7-8H,5-6H2,1-2H3,(H,15,16)/p-1