2-chloranylprop-2-enyl (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: 2-chloranylprop-2-enyl (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate Openeye Name: 2-chloroallyl (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid 2-chloroprop-2-enyl ester IUPAC Name: 2-chloroprop-2-enyl (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enoate Traditional Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]acrylic acid 2-chloroallyl ester Formula: C23H21ClN2O4 MolecularWeight: 424.87684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=CC(=O)OCC(=C)Cl)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2/C=C/C(=O)OCC(=C)Cl)C3=CC=CC=C3)OC

InChI

InChI=1S/C23H21ClN2O4/c1-16(24)15-30-22(27)12-10-18-14-26(19-7-5-4-6-8-19)25-23(18)17-9-11-20(28-2)21(13-17)29-3/h4-14H,1,15H2,2-3H3/b12-10+