[4-bromanyl-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl] 2-methyl-2-phenoxy-propanoate

Systemtic Name: [4-bromanyl-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl] 2-methyl-2-phenoxy-propanoate Openeye Name: [4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl] 2-methyl-2-phenoxy-propanoate CAS Name: 2-methyl-2-phenoxypropanoic acid [4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)-1-pyrrolyl] ester IUPAC Name: [4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl] 2-methyl-2-phenoxypropanoate Traditional Name: 2-methyl-2-phenoxy-propionic acid [4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl] ester Formula: C22H15BrClF3N2O3 MolecularWeight: 527.71831

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)ON1C(=C(C(=C1C(F)(F)F)Br)C#N)C2=CC=C(C=C2)Cl)OC3=CC=CC=C3

Isomeric SMILES

CC(C)(C(=O)ON1C(=C(C(=C1C(F)(F)F)Br)C#N)C2=CC=C(C=C2)Cl)OC3=CC=CC=C3

InChI

InChI=1S/C22H15BrClF3N2O3/c1-21(2,31-15-6-4-3-5-7-15)20(30)32-29-18(13-8-10-14(24)11-9-13)16(12-28)17(23)19(29)22(25,26)27/h3-11H,1-2H3