[2,6-bis(bromanyl)-4-cyano-phenyl] 2-(3-butoxyphenoxy)ethanoate

Systemtic Name: [2,6-bis(bromanyl)-4-cyano-phenyl] 2-(3-butoxyphenoxy)ethanoate Openeye Name: (2,6-dibromo-4-cyano-phenyl) 2-(3-butoxyphenoxy)acetate CAS Name: 2-(3-butoxyphenoxy)acetic acid (2,6-dibromo-4-cyanophenyl) ester IUPAC Name: (2,6-dibromo-4-cyanophenyl) 2-(3-butoxyphenoxy)acetate Traditional Name: 2-(3-butoxyphenoxy)acetic acid (2,6-dibromo-4-cyano-phenyl) ester Formula: C19H17Br2NO4 MolecularWeight: 483.15058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)OCC(=O)OC2=C(C=C(C=C2Br)C#N)Br

Isomeric SMILES

CCCCOC1=CC=CC(=C1)OCC(=O)OC2=C(C=C(C=C2Br)C#N)Br

InChI

InChI=1S/C19H17Br2NO4/c1-2-3-7-24-14-5-4-6-15(10-14)25-12-18(23)26-19-16(20)8-13(11-22)9-17(19)21/h4-6,8-10H,2-3,7,12H2,1H3