N-[(E)-[3-bromanyl-4-(cyanomethoxy)phenyl]methylideneamino]-2-cyano-ethanamide

Systemtic Name: N-[(E)-[3-bromanyl-4-(cyanomethoxy)phenyl]methylideneamino]-2-cyano-ethanamide Openeye Name: N-[(E)-[3-bromo-4-(cyanomethoxy)phenyl]methyleneamino]-2-cyano-acetamide CAS Name: N-[(E)-[3-bromo-4-(cyanomethoxy)phenyl]methylideneamino]-2-cyanoacetamide IUPAC Name: N-[(E)-[3-bromo-4-(cyanomethoxy)phenyl]methylideneamino]-2-cyanoacetamide Traditional Name: N-[(E)-[3-bromo-4-(cyanomethoxy)benzylidene]amino]-2-cyano-acetamide Formula: C12H9BrN4O2 MolecularWeight: 321.12946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=NNC(=O)CC#N)Br)OCC#N

Isomeric SMILES

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

InChI

InChI=1S/C12H9BrN4O2/c13-10-7-9(1-2-11(10)19-6-5-15)8-16-17-12(18)3-4-14/h1-2,7-8H,3,6H2,(H,17,18)/b16-8+