(E)-3-[3-bromanyl-4-(cyanomethoxy)-5-methoxy-phenyl]-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-[3-bromanyl-4-(cyanomethoxy)-5-methoxy-phenyl]-2-cyano-prop-2-enamide Openeye Name: (E)-3-[3-bromo-4-(cyanomethoxy)-5-methoxy-phenyl]-2-cyano-prop-2-enamide CAS Name: (E)-3-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]-2-cyano-2-propenamide IUPAC Name: (E)-3-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]-2-cyanoprop-2-enamide Traditional Name: (E)-3-[3-bromo-4-(cyanomethoxy)-5-methoxy-phenyl]-2-cyano-acrylamide Formula: C13H10BrN3O3 MolecularWeight: 336.1408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10BrN3O3/c1-19-11-6-8(4-9(7-16)13(17)18)5-10(14)12(11)20-3-2-15/h4-6H,3H2,1H3,(H2,17,18)/b9-4+