tert-butyl 2-(4-ethanoylphenyl)-5-propan-2-yl-pyrrole-1-carboxylate

Systemtic Name: tert-butyl 2-(4-ethanoylphenyl)-5-propan-2-yl-pyrrole-1-carboxylate Openeye Name: tert-butyl 2-(4-acetylphenyl)-5-isopropyl-pyrrole-1-carboxylate CAS Name: 2-(4-acetylphenyl)-5-propan-2-yl-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-acetylphenyl)-5-propan-2-ylpyrrole-1-carboxylate Traditional Name: 2-(4-acetylphenyl)-5-isopropyl-pyrrole-1-carboxylic acid tert-butyl ester Formula: C20H25NO3 MolecularWeight: 327.4174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO3/c1-13(2)17-11-12-18(21(17)19(23)24-20(4,5)6)16-9-7-15(8-10-16)14(3)22/h7-13H,1-6H3