ethyl 5-[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[2-(2,4-dichlorophenoxy)propanoylamino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[2-(2,4-dichlorophenoxy)-1-oxopropyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(2,4-dichlorophenoxy)propanoylamino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[2-(2,4-dichlorophenoxy)propanoylamino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H19Cl2N3O4 MolecularWeight: 448.29926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C(C)OC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C(C)OC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H19Cl2N3O4/c1-3-29-21(28)16-12-24-26(15-7-5-4-6-8-15)19(16)25-20(27)13(2)30-18-10-9-14(22)11-17(18)23/h4-13H,3H2,1-2H3,(H,25,27)