2-[5-(bromomethyl)-1,3-benzoxazol-2-yl]benzenecarbonitrile

Systemtic Name: 2-[5-(bromomethyl)-1,3-benzoxazol-2-yl]benzenecarbonitrile Openeye Name: 2-[5-(bromomethyl)-1,3-benzoxazol-2-yl]benzonitrile CAS Name: 2-[5-(bromomethyl)-1,3-benzoxazol-2-yl]benzonitrile IUPAC Name: 2-[5-(bromomethyl)-1,3-benzoxazol-2-yl]benzonitrile Traditional Name: 2-[5-(bromomethyl)-1,3-benzoxazol-2-yl]benzonitrile Formula: C15H9BrN2O MolecularWeight: 313.14876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)C2=NC3=C(O2)C=CC(=C3)CBr

Isomeric SMILES

C1=CC=C(C(=C1)C#N)C2=NC3=C(O2)C=CC(=C3)CBr

InChI

InChI=1S/C15H9BrN2O/c16-8-10-5-6-14-13(7-10)18-15(19-14)12-4-2-1-3-11(12)9-17/h1-7H,8H2