(E)-3-(5-cyano-1-methyl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: (E)-3-(5-cyano-1-methyl-pyrazol-4-yl)prop-2-enoate Openeye Name: (E)-3-(5-cyano-1-methyl-pyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(5-cyano-1-methyl-4-pyrazolyl)-2-propenoate IUPAC Name: (E)-3-(5-cyano-1-methylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(5-cyano-1-methyl-pyrazol-4-yl)acrylate Formula: C8H6N3O2- MolecularWeight: 176.15214

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C=CC(=O)[O-])C#N

Isomeric SMILES

CN1C(=C(C=N1)/C=C/C(=O)[O-])C#N

InChI

InChI=1S/C8H7N3O2/c1-11-7(4-9)6(5-10-11)2-3-8(12)13/h2-3,5H,1H3,(H,12,13)/p-1/b3-2+