(E)-2-(phenylcarbonyl)-3-(1-phenylpyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(phenylcarbonyl)-3-(1-phenylpyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(1-phenylpyrazol-4-yl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-(1-phenyl-4-pyrazolyl)-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-(1-phenylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(1-phenylpyrazol-4-yl)acrylonitrile Formula: C19H13N3O MolecularWeight: 299.32602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(=CC2=CN(N=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C(=C/C2=CN(N=C2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C19H13N3O/c20-12-17(19(23)16-7-3-1-4-8-16)11-15-13-21-22(14-15)18-9-5-2-6-10-18/h1-11,13-14H/b17-11+