ethyl 5-benzamido-4-cyano-3-methyl-1-phenyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 5-benzamido-4-cyano-3-methyl-1-phenyl-pyrrole-2-carboxylate Openeye Name: ethyl 5-benzamido-4-cyano-3-methyl-1-phenyl-pyrrole-2-carboxylate CAS Name: 5-benzamido-4-cyano-3-methyl-1-phenyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzamido-4-cyano-3-methyl-1-phenylpyrrole-2-carboxylate Traditional Name: 5-benzamido-4-cyano-3-methyl-1-phenyl-pyrrole-2-carboxylic acid ethyl ester Formula: C22H19N3O3 MolecularWeight: 373.40456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C#N)C

InChI

InChI=1S/C22H19N3O3/c1-3-28-22(27)19-15(2)18(14-23)20(25(19)17-12-8-5-9-13-17)24-21(26)16-10-6-4-7-11-16/h4-13H,3H2,1-2H3,(H,24,26)