2-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]ethanenitrile

Systemtic Name: 2-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]ethanenitrile Openeye Name: 2-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]acetonitrile CAS Name: 2-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]acetonitrile IUPAC Name: 2-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]acetonitrile Traditional Name: 2-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]acetonitrile Formula: C19H13N3O MolecularWeight: 299.32602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)CC#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)CC#N

InChI

InChI=1S/C19H13N3O/c20-11-10-15-13-22(16-7-2-1-3-8-16)21-19(15)18-12-14-6-4-5-9-17(14)23-18/h1-9,12-13H,10H2