methyl (E)-3-[4-[2-(4-bromanyl-3-methyl-phenoxy)ethanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-[4-[2-(4-bromanyl-3-methyl-phenoxy)ethanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-[4-[2-(4-bromo-3-methyl-phenoxy)acetyl]oxy-3-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-[2-(4-bromo-3-methylphenoxy)-1-oxoethoxy]-3-methoxyphenyl]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-[2-(4-bromo-3-methylphenoxy)acetyl]oxy-3-methoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-[2-(4-bromo-3-methyl-phenoxy)acetyl]oxy-3-methoxy-phenyl]-2-cyano-acrylic acid methyl ester Formula: C21H18BrNO6 MolecularWeight: 460.27472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrNO6/c1-13-8-16(5-6-17(13)22)28-12-20(24)29-18-7-4-14(10-19(18)26-2)9-15(11-23)21(25)27-3/h4-10H,12H2,1-3H3/b15-9+