3,5-dimethyl-4-[(E)-3-thiophen-3-ylprop-2-enoyl]-1H-pyrrole-2-carboxylate

Systemtic Name: 3,5-dimethyl-4-[(E)-3-thiophen-3-ylprop-2-enoyl]-1H-pyrrole-2-carboxylate Openeye Name: 3,5-dimethyl-4-[(E)-3-(3-thienyl)prop-2-enoyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[(E)-1-oxo-3-(3-thiophenyl)prop-2-enyl]-1H-pyrrole-2-carboxylate IUPAC Name: 3,5-dimethyl-4-[(E)-3-thiophen-3-ylprop-2-enoyl]-1H-pyrrole-2-carboxylate Traditional Name: 3,5-dimethyl-4-[(E)-3-(3-thienyl)acryloyl]-1H-pyrrole-2-carboxylate Formula: C14H12NO3S- MolecularWeight: 274.31498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C=CC2=CSC=C2)C)C(=O)[O-]

Isomeric SMILES

CC1=C(NC(=C1C(=O)/C=C/C2=CSC=C2)C)C(=O)[O-]

InChI

InChI=1S/C14H13NO3S/c1-8-12(9(2)15-13(8)14(17)18)11(16)4-3-10-5-6-19-7-10/h3-7,15H,1-2H3,(H,17,18)/p-1/b4-3+