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

Systemtic Name: 2-[1-(3-bromophenyl)-3-oxidanylidene-3-phenyl-propyl]propanedinitrile Openeye Name: 2-[1-(3-bromophenyl)-3-oxo-3-phenyl-propyl]propanedinitrile CAS Name: 2-[1-(3-bromophenyl)-3-oxo-3-phenylpropyl]propanedinitrile IUPAC Name: 2-[1-(3-bromophenyl)-3-oxo-3-phenylpropyl]propanedinitrile Traditional Name: 2-[1-(3-bromophenyl)-3-keto-3-phenyl-propyl]malononitrile Formula: C18H13BrN2O MolecularWeight: 353.21262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13BrN2O/c19-16-8-4-7-14(9-16)17(15(11-20)12-21)10-18(22)13-5-2-1-3-6-13/h1-9,15,17H,10H2