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

Systemtic Name: 4-[[5-(4-bromanylphenoxy)imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-(4-bromophenoxy)imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-(4-bromophenoxy)-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-(4-bromophenoxy)imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-(4-bromophenoxy)imidazol-1-yl]methyl]benzonitrile Formula: C17H12BrN3O MolecularWeight: 354.20068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC=C2OC3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC=C2OC3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C17H12BrN3O/c18-15-5-7-16(8-6-15)22-17-10-20-12-21(17)11-14-3-1-13(9-19)2-4-14/h1-8,10,12H,11H2