butyl 5-(4-chlorophenyl)-2-[(4-chlorophenyl)carbamoyl]-4-methyl-3H-pyrazole-4-carboxylate

Systemtic Name: butyl 5-(4-chlorophenyl)-2-[(4-chlorophenyl)carbamoyl]-4-methyl-3H-pyrazole-4-carboxylate Openeye Name: butyl 5-(4-chlorophenyl)-2-[(4-chlorophenyl)carbamoyl]-4-methyl-3H-pyrazole-4-carboxylate CAS Name: 2-[(4-chloroanilino)-oxomethyl]-5-(4-chlorophenyl)-4-methyl-3H-pyrazole-4-carboxylic acid butyl ester IUPAC Name: butyl 5-(4-chlorophenyl)-2-[(4-chlorophenyl)carbamoyl]-4-methyl-3H-pyrazole-4-carboxylate Traditional Name: 3-(4-chlorophenyl)-1-[(4-chlorophenyl)carbamoyl]-4-methyl-2-pyrazoline-4-carboxylic acid butyl ester Formula: C22H23Cl2N3O3 MolecularWeight: 448.34232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCCCOC(=O)C1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H23Cl2N3O3/c1-3-4-13-30-20(28)22(2)14-27(21(29)25-18-11-9-17(24)10-12-18)26-19(22)15-5-7-16(23)8-6-15/h5-12H,3-4,13-14H2,1-2H3,(H,25,29)