cyanomethyl (E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoate

Systemtic Name: cyanomethyl (E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoate Openeye Name: cyanomethyl (E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-2-propenoic acid cyanomethyl ester IUPAC Name: cyanomethyl (E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)acrylic acid cyanomethyl ester Formula: C12H10BrNO3 MolecularWeight: 296.1167

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)OCC#N

InChI

InChI=1S/C12H10BrNO3/c1-16-11-4-3-10(13)8-9(11)2-5-12(15)17-7-6-14/h2-5,8H,7H2,1H3/b5-2+