cyanomethyl 2-(2-bromanyl-4,5-dimethoxy-phenyl)ethanoate

Systemtic Name: cyanomethyl 2-(2-bromanyl-4,5-dimethoxy-phenyl)ethanoate Openeye Name: cyanomethyl 2-(2-bromo-4,5-dimethoxy-phenyl)acetate CAS Name: 2-(2-bromo-4,5-dimethoxyphenyl)acetic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(2-bromo-4,5-dimethoxyphenyl)acetate Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)acetic acid cyanomethyl ester Formula: C12H12BrNO4 MolecularWeight: 314.13198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(=O)OCC#N)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC(=O)OCC#N)Br)OC

InChI

InChI=1S/C12H12BrNO4/c1-16-10-5-8(6-12(15)18-4-3-14)9(13)7-11(10)17-2/h5,7H,4,6H2,1-2H3