(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 3-(2,3-dimethoxyphenyl)propanoate

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 3-(2,3-dimethoxyphenyl)propanoate Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl 3-(2,3-dimethoxyphenyl)propanoate CAS Name: 3-(2,3-dimethoxyphenyl)propanoic acid (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl 3-(2,3-dimethoxyphenyl)propanoate Traditional Name: 3-(2,3-dimethoxyphenyl)propionic acid (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C22H23ClN2O4 MolecularWeight: 414.88202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1COC(=O)CCC2=C(C(=CC=C2)OC)OC)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1COC(=O)CCC2=C(C(=CC=C2)OC)OC)Cl)C3=CC=CC=C3

InChI

InChI=1S/C22H23ClN2O4/c1-15-18(22(23)25(24-15)17-9-5-4-6-10-17)14-29-20(26)13-12-16-8-7-11-19(27-2)21(16)28-3/h4-11H,12-14H2,1-3H3