(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate

Systemtic Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Openeye Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,4,5-trimethoxyphenyl)-2-propenoic acid (4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methyl ester IUPAC Name: (4-cyano-5-methyl-2-phenylpyrazol-3-yl)methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-asarylacrylic acid (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl ester Formula: C24H23N3O5 MolecularWeight: 433.45652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)COC(=O)C=CC2=CC(=C(C=C2OC)OC)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C#N)COC(=O)/C=C/C2=CC(=C(C=C2OC)OC)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H23N3O5/c1-16-19(14-25)20(27(26-16)18-8-6-5-7-9-18)15-32-24(28)11-10-17-12-22(30-3)23(31-4)13-21(17)29-2/h5-13H,15H2,1-4H3/b11-10+