methyl 4-cyano-1-phenacyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-cyano-1-phenacyl-pyrrole-2-carboxylate Openeye Name: methyl 4-cyano-1-phenacyl-pyrrole-2-carboxylate CAS Name: 4-cyano-1-phenacyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-1-phenacylpyrrole-2-carboxylate Traditional Name: 4-cyano-1-phenacyl-pyrrole-2-carboxylic acid methyl ester Formula: C15H12N2O3 MolecularWeight: 268.26738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN1CC(=O)C2=CC=CC=C2)C#N

Isomeric SMILES

COC(=O)C1=CC(=CN1CC(=O)C2=CC=CC=C2)C#N

InChI

InChI=1S/C15H12N2O3/c1-20-15(19)13-7-11(8-16)9-17(13)10-14(18)12-5-3-2-4-6-12/h2-7,9H,10H2,1H3