1-[(3-chloranyl-4-methoxy-phenyl)methyl]imidazole-4,5-dicarbonitrile

Systemtic Name: 1-[(3-chloranyl-4-methoxy-phenyl)methyl]imidazole-4,5-dicarbonitrile Openeye Name: 1-[(3-chloro-4-methoxy-phenyl)methyl]imidazole-4,5-dicarbonitrile CAS Name: 1-[(3-chloro-4-methoxyphenyl)methyl]imidazole-4,5-dicarbonitrile IUPAC Name: 1-[(3-chloro-4-methoxyphenyl)methyl]imidazole-4,5-dicarbonitrile Traditional Name: 1-(3-chloro-4-methoxy-benzyl)imidazole-4,5-dicarbonitrile Formula: C13H9ClN4O MolecularWeight: 272.68976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C=NC(=C2C#N)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C=NC(=C2C#N)C#N)Cl

InChI

InChI=1S/C13H9ClN4O/c1-19-13-3-2-9(4-10(13)14)7-18-8-17-11(5-15)12(18)6-16/h2-4,8H,7H2,1H3