(1,3-diphenylpyrazol-4-yl)methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(3,4,5-trimethoxyphenyl)-2-propenoic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3,4,5-trimethoxyphenyl)acrylic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C28H26N2O5 MolecularWeight: 470.51644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H26N2O5/c1-32-24-16-20(17-25(33-2)28(24)34-3)14-15-26(31)35-19-22-18-30(23-12-8-5-9-13-23)29-27(22)21-10-6-4-7-11-21/h4-18H,19H2,1-3H3/b15-14+