4-[4-[2-(3-bromophenyl)-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[2-(3-bromophenyl)-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-(3-bromophenyl)-2-oxo-ethoxy]phenyl]benzonitrile CAS Name: 4-[4-[2-(3-bromophenyl)-2-oxoethoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[2-(3-bromophenyl)-2-oxoethoxy]phenyl]benzonitrile Traditional Name: 4-[4-[2-(3-bromophenyl)-2-keto-ethoxy]phenyl]benzonitrile Formula: C21H14BrNO2 MolecularWeight: 392.24536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H14BrNO2/c22-19-3-1-2-18(12-19)21(24)14-25-20-10-8-17(9-11-20)16-6-4-15(13-23)5-7-16/h1-12H,14H2