ethyl 5-(4-cyclobutylphenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(4-cyclobutylphenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-(4-cyclobutylphenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazole-3-carboxylate CAS Name: 5-(4-cyclobutylphenyl)-1-(2,4-dichlorophenyl)-4-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-cyclobutylphenyl)-1-(2,4-dichlorophenyl)-4-methylpyrazole-3-carboxylate Traditional Name: 5-(4-cyclobutylphenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C23H22Cl2N2O2 MolecularWeight: 429.33898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1C)C2=CC=C(C=C2)C3CCC3)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1C)C2=CC=C(C=C2)C3CCC3)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H22Cl2N2O2/c1-3-29-23(28)21-14(2)22(17-9-7-16(8-10-17)15-5-4-6-15)27(26-21)20-12-11-18(24)13-19(20)25/h7-13,15H,3-6H2,1-2H3