methyl (E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-2-cyano-acrylic acid methyl ester Formula: C12H10BrNO4 MolecularWeight: 312.1161

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C=C(C(=C1)Br)/C=C(\C#N)/C(=O)OC)O

InChI

InChI=1S/C12H10BrNO4/c1-17-11-5-9(13)7(4-10(11)15)3-8(6-14)12(16)18-2/h3-5,15H,1-2H3/b8-3+