4-[(5-methanoylimidazol-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(5-methanoylimidazol-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(5-formylimidazol-1-yl)methyl]benzonitrile CAS Name: 4-[(5-formyl-1-imidazolyl)methyl]benzonitrile IUPAC Name: 4-[(5-formylimidazol-1-yl)methyl]benzonitrile Traditional Name: 4-[(5-formylimidazol-1-yl)methyl]benzonitrile Formula: C12H9N3O MolecularWeight: 211.21936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC=C2C=O)C#N

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC=C2C=O)C#N

InChI

InChI=1S/C12H9N3O/c13-5-10-1-3-11(4-2-10)7-15-9-14-6-12(15)8-16/h1-4,6,8-9H,7H2