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

Systemtic Name: (E)-3-(1-phenylpyrazol-4-yl)-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-(1-phenylpyrazol-4-yl)-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile CAS Name: (E)-2-[oxo(1-pyrrolidinyl)methyl]-3-(1-phenyl-4-pyrazolyl)-2-propenenitrile IUPAC Name: (E)-3-(1-phenylpyrazol-4-yl)-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(1-phenylpyrazol-4-yl)-2-(pyrrolidine-1-carbonyl)acrylonitrile Formula: C17H16N4O MolecularWeight: 292.33514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(=CC2=CN(N=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

C1CCN(C1)C(=O)/C(=C/C2=CN(N=C2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C17H16N4O/c18-11-15(17(22)20-8-4-5-9-20)10-14-12-19-21(13-14)16-6-2-1-3-7-16/h1-3,6-7,10,12-13H,4-5,8-9H2/b15-10+