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

Systemtic Name: 2-(4-methanoyl-3-phenyl-pyrazol-1-yl)ethanenitrile Openeye Name: 2-(4-formyl-3-phenyl-pyrazol-1-yl)acetonitrile CAS Name: 2-(4-formyl-3-phenyl-1-pyrazolyl)acetonitrile IUPAC Name: 2-(4-formyl-3-phenylpyrazol-1-yl)acetonitrile Traditional Name: 2-(4-formyl-3-phenyl-pyrazol-1-yl)acetonitrile Formula: C12H9N3O MolecularWeight: 211.21936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=O)CC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C=O)CC#N

InChI

InChI=1S/C12H9N3O/c13-6-7-15-8-11(9-16)12(14-15)10-4-2-1-3-5-10/h1-5,8-9H,7H2