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

Systemtic Name: (1-phenylpyrazol-4-yl)methyl (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: (1-phenylpyrazol-4-yl)methyl (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-methoxyphenyl)-2-propenoic acid (1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (1-phenylpyrazol-4-yl)methyl (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-methoxyphenyl)acrylic acid (1-phenylpyrazol-4-yl)methyl ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C#N)C(=O)OCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H17N3O3/c1-26-20-9-7-16(8-10-20)11-18(12-22)21(25)27-15-17-13-23-24(14-17)19-5-3-2-4-6-19/h2-11,13-14H,15H2,1H3/b18-11+