[2,6-bis(bromanyl)-4-cyano-phenyl] 2-(4-phenoxyphenoxy)ethanoate

Systemtic Name: [2,6-bis(bromanyl)-4-cyano-phenyl] 2-(4-phenoxyphenoxy)ethanoate Openeye Name: (2,6-dibromo-4-cyano-phenyl) 2-(4-phenoxyphenoxy)acetate CAS Name: 2-(4-phenoxyphenoxy)acetic acid (2,6-dibromo-4-cyanophenyl) ester IUPAC Name: (2,6-dibromo-4-cyanophenyl) 2-(4-phenoxyphenoxy)acetate Traditional Name: 2-(4-phenoxyphenoxy)acetic acid (2,6-dibromo-4-cyano-phenyl) ester Formula: C21H13Br2NO4 MolecularWeight: 503.14022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)OCC(=O)OC3=C(C=C(C=C3Br)C#N)Br

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)OCC(=O)OC3=C(C=C(C=C3Br)C#N)Br

InChI

InChI=1S/C21H13Br2NO4/c22-18-10-14(12-24)11-19(23)21(18)28-20(25)13-26-15-6-8-17(9-7-15)27-16-4-2-1-3-5-16/h1-11H,13H2