methyl (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]acrylic acid methyl ester Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C=NN2)C=C(C#N)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C=NN2)/C=C(\C#N)/C(=O)OC

InChI

InChI=1S/C16H15N3O2/c1-3-11-4-6-12(7-5-11)15-14(10-18-19-15)8-13(9-17)16(20)21-2/h4-8,10H,3H2,1-2H3,(H,18,19)/b13-8+