[4-(2-cyano-2-phenyl-ethenyl)-2-methoxy-phenyl] 2-(2-bromanyl-4-methyl-phenoxy)ethanoate

Systemtic Name: [4-(2-cyano-2-phenyl-ethenyl)-2-methoxy-phenyl] 2-(2-bromanyl-4-methyl-phenoxy)ethanoate Openeye Name: [4-(2-cyano-2-phenyl-vinyl)-2-methoxy-phenyl] 2-(2-bromo-4-methyl-phenoxy)acetate CAS Name: 2-(2-bromo-4-methylphenoxy)acetic acid [4-(2-cyano-2-phenylethenyl)-2-methoxyphenyl] ester IUPAC Name: [4-(2-cyano-2-phenylethenyl)-2-methoxyphenyl] 2-(2-bromo-4-methylphenoxy)acetate Traditional Name: 2-(2-bromo-4-methyl-phenoxy)acetic acid [4-(2-cyano-2-phenyl-vinyl)-2-methoxy-phenyl] ester Formula: C25H20BrNO4 MolecularWeight: 478.3346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)OC2=C(C=C(C=C2)C=C(C#N)C3=CC=CC=C3)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)OC2=C(C=C(C=C2)C=C(C#N)C3=CC=CC=C3)OC)Br

InChI

InChI=1S/C25H20BrNO4/c1-17-8-10-22(21(26)12-17)30-16-25(28)31-23-11-9-18(14-24(23)29-2)13-20(15-27)19-6-4-3-5-7-19/h3-14H,16H2,1-2H3