methyl 4-[3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoyloxymethyl]benzoate

Systemtic Name: methyl 4-[3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoyloxymethyl]benzoate Openeye Name: methyl 4-[3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoyloxymethyl]benzoate CAS Name: 4-[[3-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-1-oxoprop-2-enoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enoyloxymethyl]benzoate Traditional Name: 4-[[3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]acryloyl]oxymethyl]benzoic acid methyl ester Formula: C29H26N2O6 MolecularWeight: 498.52654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=CC(=O)OCC3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C=CC(=O)OCC3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4)OC

InChI

InChI=1S/C29H26N2O6/c1-34-25-15-13-22(17-26(25)35-2)28-23(18-31(30-28)24-7-5-4-6-8-24)14-16-27(32)37-19-20-9-11-21(12-10-20)29(33)36-3/h4-18H,19H2,1-3H3