methyl 2-[4-chloranyl-2-(2-ethyl-5-phenyl-pyrazol-3-yl)phenoxy]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[4-chloranyl-2-(2-ethyl-5-phenyl-pyrazol-3-yl)phenoxy]-2-phenyl-ethanoate Openeye Name: methyl 2-[4-chloro-2-(2-ethyl-5-phenyl-pyrazol-3-yl)phenoxy]-2-phenyl-acetate CAS Name: 2-[4-chloro-2-(2-ethyl-5-phenyl-3-pyrazolyl)phenoxy]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[4-chloro-2-(2-ethyl-5-phenylpyrazol-3-yl)phenoxy]-2-phenylacetate Traditional Name: 2-[4-chloro-2-(2-ethyl-5-phenyl-pyrazol-3-yl)phenoxy]-2-phenyl-acetic acid methyl ester Formula: C26H23ClN2O3 MolecularWeight: 446.92542

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C2=CC=CC=C2)C3=C(C=CC(=C3)Cl)OC(C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CCN1C(=CC(=N1)C2=CC=CC=C2)C3=C(C=CC(=C3)Cl)OC(C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C26H23ClN2O3/c1-3-29-23(17-22(28-29)18-10-6-4-7-11-18)21-16-20(27)14-15-24(21)32-25(26(30)31-2)19-12-8-5-9-13-19/h4-17,25H,3H2,1-2H3