(E)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enoate

Systemtic Name: (E)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enoate Openeye Name: (E)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-(1-phenyl-4-pyrazolyl)-2-propenoate IUPAC Name: (E)-2-cyano-3-(1-phenylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(1-phenylpyrazol-4-yl)acrylate Formula: C13H8N3O2- MolecularWeight: 238.22152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C=C(C#N)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)/C=C(\C#N)/C(=O)[O-]

InChI

InChI=1S/C13H9N3O2/c14-7-11(13(17)18)6-10-8-15-16(9-10)12-4-2-1-3-5-12/h1-6,8-9H,(H,17,18)/p-1/b11-6+