[4-chloranyl-2-[3-(3,4-dimethoxyphenyl)-2-ethanoyl-3,4-dihydropyrazol-5-yl]phenyl] ethanoate

Systemtic Name: [4-chloranyl-2-[3-(3,4-dimethoxyphenyl)-2-ethanoyl-3,4-dihydropyrazol-5-yl]phenyl] ethanoate Openeye Name: [2-[2-acetyl-3-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-5-yl]-4-chloro-phenyl] acetate CAS Name: acetic acid [2-[2-acetyl-3-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-5-yl]-4-chlorophenyl] ester IUPAC Name: [2-[2-acetyl-3-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-5-yl]-4-chlorophenyl] acetate Traditional Name: acetic acid [2-[1-acetyl-5-(3,4-dimethoxyphenyl)-2-pyrazolin-3-yl]-4-chloro-phenyl] ester Formula: C21H21ClN2O5 MolecularWeight: 416.85484

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=N1)C2=C(C=CC(=C2)Cl)OC(=O)C)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(=O)N1C(CC(=N1)C2=C(C=CC(=C2)Cl)OC(=O)C)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H21ClN2O5/c1-12(25)24-18(14-5-7-20(27-3)21(9-14)28-4)11-17(23-24)16-10-15(22)6-8-19(16)29-13(2)26/h5-10,18H,11H2,1-4H3