tert-butyl 3-phenyl-4-(phenylcarbonyl)pyrrole-1-carboxylate

Systemtic Name: tert-butyl 3-phenyl-4-(phenylcarbonyl)pyrrole-1-carboxylate Openeye Name: tert-butyl 3-benzoyl-4-phenyl-pyrrole-1-carboxylate CAS Name: 3-benzoyl-4-phenyl-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-benzoyl-4-phenylpyrrole-1-carboxylate Traditional Name: 3-benzoyl-4-phenyl-pyrrole-1-carboxylic acid tert-butyl ester Formula: C22H21NO3 MolecularWeight: 347.40704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C(=C1)C(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C(=C1)C(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO3/c1-22(2,3)26-21(25)23-14-18(16-10-6-4-7-11-16)19(15-23)20(24)17-12-8-5-9-13-17/h4-15H,1-3H3