ethyl 2-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]-5-(4-chlorophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]-5-(4-chlorophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 2-[3-(4-chlorophenoxy)-2-hydroxy-propyl]-5-(4-chlorophenyl)pyrazole-3-carboxylate CAS Name: 2-[3-(4-chlorophenoxy)-2-hydroxypropyl]-5-(4-chlorophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-chlorophenoxy)-2-hydroxypropyl]-5-(4-chlorophenyl)pyrazole-3-carboxylate Traditional Name: 2-[3-(4-chlorophenoxy)-2-hydroxy-propyl]-5-(4-chlorophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C21H20Cl2N2O4 MolecularWeight: 435.3005

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1CC(COC2=CC=C(C=C2)Cl)O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=NN1CC(COC2=CC=C(C=C2)Cl)O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20Cl2N2O4/c1-2-28-21(27)20-11-19(14-3-5-15(22)6-4-14)24-25(20)12-17(26)13-29-18-9-7-16(23)8-10-18/h3-11,17,26H,2,12-13H2,1H3