2-(3-bromanyl-4-pyrazol-1-yl-phenyl)ethanenitrile

Systemtic Name: 2-(3-bromanyl-4-pyrazol-1-yl-phenyl)ethanenitrile Openeye Name: 2-(3-bromo-4-pyrazol-1-yl-phenyl)acetonitrile CAS Name: 2-[3-bromo-4-(1-pyrazolyl)phenyl]acetonitrile IUPAC Name: 2-(3-bromo-4-pyrazol-1-ylphenyl)acetonitrile Traditional Name: 2-(3-bromo-4-pyrazol-1-yl-phenyl)acetonitrile Formula: C11H8BrN3 MolecularWeight: 262.10532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=C(C=C(C=C2)CC#N)Br

Isomeric SMILES

C1=CN(N=C1)C2=C(C=C(C=C2)CC#N)Br

InChI

InChI=1S/C11H8BrN3/c12-10-8-9(4-5-13)2-3-11(10)15-7-1-6-14-15/h1-3,6-8H,4H2