2-[2-(4-bromanylphenoxy)-3-phenoxy-phenyl]ethanenitrile

Systemtic Name: 2-[2-(4-bromanylphenoxy)-3-phenoxy-phenyl]ethanenitrile Openeye Name: 2-[2-(4-bromophenoxy)-3-phenoxy-phenyl]acetonitrile CAS Name: 2-[2-(4-bromophenoxy)-3-phenoxyphenyl]acetonitrile IUPAC Name: 2-[2-(4-bromophenoxy)-3-phenoxyphenyl]acetonitrile Traditional Name: 2-[2-(4-bromophenoxy)-3-phenoxy-phenyl]acetonitrile Formula: C20H14BrNO2 MolecularWeight: 380.23466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2OC3=CC=C(C=C3)Br)CC#N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2OC3=CC=C(C=C3)Br)CC#N

InChI

InChI=1S/C20H14BrNO2/c21-16-9-11-18(12-10-16)24-20-15(13-14-22)5-4-8-19(20)23-17-6-2-1-3-7-17/h1-12H,13H2