[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 3-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: [2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 3-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate Openeye Name: [2-(2,4-dimethoxyphenyl)-2-oxo-ethyl] 3-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate CAS Name: 3-[3-(3-nitrophenyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid [2-(2,4-dimethoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethoxyphenyl)-2-oxoethyl] 3-[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]prop-2-enoate Traditional Name: 3-[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]acrylic acid [2-(2,4-dimethoxyphenyl)-2-keto-ethyl] ester Formula: C28H23N3O7 MolecularWeight: 513.49812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)COC(=O)C=CC2=CN(N=C2C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)COC(=O)C=CC2=CN(N=C2C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)OC

InChI

InChI=1S/C28H23N3O7/c1-36-23-12-13-24(26(16-23)37-2)25(32)18-38-27(33)14-11-20-17-30(21-8-4-3-5-9-21)29-28(20)19-7-6-10-22(15-19)31(34)35/h3-17H,18H2,1-2H3