ethyl 3-[3,5-bis(3,4-dichlorophenyl)-4-methyl-pyrazol-1-yl]propanoate

Systemtic Name: ethyl 3-[3,5-bis(3,4-dichlorophenyl)-4-methyl-pyrazol-1-yl]propanoate Openeye Name: ethyl 3-[3,5-bis(3,4-dichlorophenyl)-4-methyl-pyrazol-1-yl]propanoate CAS Name: 3-[3,5-bis(3,4-dichlorophenyl)-4-methyl-1-pyrazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3,5-bis(3,4-dichlorophenyl)-4-methylpyrazol-1-yl]propanoate Traditional Name: 3-[3,5-bis(3,4-dichlorophenyl)-4-methyl-pyrazol-1-yl]propionic acid ethyl ester Formula: C21H18Cl4N2O2 MolecularWeight: 472.19182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C(=C(C(=N1)C2=CC(=C(C=C2)Cl)Cl)C)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC(=O)CCN1C(=C(C(=N1)C2=CC(=C(C=C2)Cl)Cl)C)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H18Cl4N2O2/c1-3-29-19(28)8-9-27-21(14-5-7-16(23)18(25)11-14)12(2)20(26-27)13-4-6-15(22)17(24)10-13/h4-7,10-11H,3,8-9H2,1-2H3