3-[5-(4-bromophenyl)-1-(4-propan-2-ylphenyl)pyrrol-2-yl]propanoate

Systemtic Name: 3-[5-(4-bromophenyl)-1-(4-propan-2-ylphenyl)pyrrol-2-yl]propanoate Openeye Name: 3-[5-(4-bromophenyl)-1-(4-isopropylphenyl)pyrrol-2-yl]propanoate CAS Name: 3-[5-(4-bromophenyl)-1-(4-propan-2-ylphenyl)-2-pyrrolyl]propanoate IUPAC Name: 3-[5-(4-bromophenyl)-1-(4-propan-2-ylphenyl)pyrrol-2-yl]propanoate Traditional Name: 3-[5-(4-bromophenyl)-1-p-cumenyl-pyrrol-2-yl]propionate Formula: C22H21BrNO2- MolecularWeight: 411.31164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=CC=C2C3=CC=C(C=C3)Br)CCC(=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=CC=C2C3=CC=C(C=C3)Br)CCC(=O)[O-]

InChI

InChI=1S/C22H22BrNO2/c1-15(2)16-5-9-19(10-6-16)24-20(12-14-22(25)26)11-13-21(24)17-3-7-18(23)8-4-17/h3-11,13,15H,12,14H2,1-2H3,(H,25,26)/p-1