4-[[5-(chloromethyl)imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-(chloromethyl)imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-(chloromethyl)imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-(chloromethyl)-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-(chloromethyl)imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-(chloromethyl)imidazol-1-yl]methyl]benzonitrile Formula: C12H10ClN3 MolecularWeight: 231.6809

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC=C2CCl)C#N

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC=C2CCl)C#N

InChI

InChI=1S/C12H10ClN3/c13-5-12-7-15-9-16(12)8-11-3-1-10(6-14)2-4-11/h1-4,7,9H,5,8H2