N-[(E)-(4-bromanyl-2,5-dimethoxy-phenyl)methylideneamino]-2-cyano-ethanamide

Systemtic Name: N-[(E)-(4-bromanyl-2,5-dimethoxy-phenyl)methylideneamino]-2-cyano-ethanamide Openeye Name: N-[(E)-(4-bromo-2,5-dimethoxy-phenyl)methyleneamino]-2-cyano-acetamide CAS Name: N-[(E)-(4-bromo-2,5-dimethoxyphenyl)methylideneamino]-2-cyanoacetamide IUPAC Name: N-[(E)-(4-bromo-2,5-dimethoxyphenyl)methylideneamino]-2-cyanoacetamide Traditional Name: N-[(E)-(4-bromo-2,5-dimethoxy-benzylidene)amino]-2-cyano-acetamide Formula: C12H12BrN3O3 MolecularWeight: 326.14598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=NNC(=O)CC#N)OC)Br

Isomeric SMILES

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

InChI

InChI=1S/C12H12BrN3O3/c1-18-10-6-9(13)11(19-2)5-8(10)7-15-16-12(17)3-4-14/h5-7H,3H2,1-2H3,(H,16,17)/b15-7+