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

Systemtic Name: 3-[5-(1,3-benzoxazol-2-yl)-2-(bromomethyl)phenyl]benzenecarbonitrile Openeye Name: 3-[5-(1,3-benzoxazol-2-yl)-2-(bromomethyl)phenyl]benzonitrile CAS Name: 3-[5-(1,3-benzoxazol-2-yl)-2-(bromomethyl)phenyl]benzonitrile IUPAC Name: 3-[5-(1,3-benzoxazol-2-yl)-2-(bromomethyl)phenyl]benzonitrile Traditional Name: 3-[5-(1,3-benzoxazol-2-yl)-2-(bromomethyl)phenyl]benzonitrile Formula: C21H13BrN2O MolecularWeight: 389.24472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=CC(=C(C=C3)CBr)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=CC(=C(C=C3)CBr)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H13BrN2O/c22-12-17-9-8-16(21-24-19-6-1-2-7-20(19)25-21)11-18(17)15-5-3-4-14(10-15)13-23/h1-11H,12H2