2-[1-(3-bromophenyl)-3-(4-chlorophenyl)-3-oxidanylidene-propyl]propanedinitrile

Systemtic Name: 2-[1-(3-bromophenyl)-3-(4-chlorophenyl)-3-oxidanylidene-propyl]propanedinitrile Openeye Name: 2-[1-(3-bromophenyl)-3-(4-chlorophenyl)-3-oxo-propyl]propanedinitrile CAS Name: 2-[1-(3-bromophenyl)-3-(4-chlorophenyl)-3-oxopropyl]propanedinitrile IUPAC Name: 2-[1-(3-bromophenyl)-3-(4-chlorophenyl)-3-oxopropyl]propanedinitrile Traditional Name: 2-[1-(3-bromophenyl)-3-(4-chlorophenyl)-3-keto-propyl]malononitrile Formula: C18H12BrClN2O MolecularWeight: 387.65768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(CC(=O)C2=CC=C(C=C2)Cl)C(C#N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(CC(=O)C2=CC=C(C=C2)Cl)C(C#N)C#N

InChI

InChI=1S/C18H12BrClN2O/c19-15-3-1-2-13(8-15)17(14(10-21)11-22)9-18(23)12-4-6-16(20)7-5-12/h1-8,14,17H,9H2