2-[4-bromanyl-5-(4-chlorophenyl)carbonyl-1-ethyl-pyrrol-2-yl]ethanenitrile

Systemtic Name: 2-[4-bromanyl-5-(4-chlorophenyl)carbonyl-1-ethyl-pyrrol-2-yl]ethanenitrile Openeye Name: 2-[4-bromo-5-(4-chlorobenzoyl)-1-ethyl-pyrrol-2-yl]acetonitrile CAS Name: 2-[4-bromo-5-[(4-chlorophenyl)-oxomethyl]-1-ethyl-2-pyrrolyl]acetonitrile IUPAC Name: 2-[4-bromo-5-(4-chlorobenzoyl)-1-ethylpyrrol-2-yl]acetonitrile Traditional Name: 2-[4-bromo-5-(4-chlorobenzoyl)-1-ethyl-pyrrol-2-yl]acetonitrile Formula: C15H12BrClN2O MolecularWeight: 351.62558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C(=O)C2=CC=C(C=C2)Cl)Br)CC#N

Isomeric SMILES

CCN1C(=CC(=C1C(=O)C2=CC=C(C=C2)Cl)Br)CC#N

InChI

InChI=1S/C15H12BrClN2O/c1-2-19-12(7-8-18)9-13(16)14(19)15(20)10-3-5-11(17)6-4-10/h3-6,9H,2,7H2,1H3