tert-butyl 2-bromanyl-4-phenyl-3-(phenylcarbonyl)pyrrole-1-carboxylate

Systemtic Name: tert-butyl 2-bromanyl-4-phenyl-3-(phenylcarbonyl)pyrrole-1-carboxylate Openeye Name: tert-butyl 3-benzoyl-2-bromo-4-phenyl-pyrrole-1-carboxylate CAS Name: 3-benzoyl-2-bromo-4-phenyl-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-benzoyl-2-bromo-4-phenylpyrrole-1-carboxylate Traditional Name: 3-benzoyl-2-bromo-4-phenyl-pyrrole-1-carboxylic acid tert-butyl ester Formula: C22H20BrNO3 MolecularWeight: 426.3031

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C(=C1Br)C(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C(=C1Br)C(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H20BrNO3/c1-22(2,3)27-21(26)24-14-17(15-10-6-4-7-11-15)18(20(24)23)19(25)16-12-8-5-9-13-16/h4-14H,1-3H3