[4-(methylcarbamoyl)phenyl] 1-(3-chloranyl-4-methyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxylate

Systemtic Name: [4-(methylcarbamoyl)phenyl] 1-(3-chloranyl-4-methyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxylate Openeye Name: [4-(methylcarbamoyl)phenyl] 1-(3-chloro-4-methyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxylate CAS Name: 1-(3-chloro-4-methylphenyl)-5-cyclopropyl-4-pyrazolecarboxylic acid [4-(methylcarbamoyl)phenyl] ester IUPAC Name: [4-(methylcarbamoyl)phenyl] 1-(3-chloro-4-methylphenyl)-5-cyclopropylpyrazole-4-carboxylate Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxylic acid [4-(methylcarbamoyl)phenyl] ester Formula: C22H20ClN3O3 MolecularWeight: 409.8655

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)OC3=CC=C(C=C3)C(=O)NC)C4CC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)OC3=CC=C(C=C3)C(=O)NC)C4CC4)Cl

InChI

InChI=1S/C22H20ClN3O3/c1-13-3-8-16(11-19(13)23)26-20(14-4-5-14)18(12-25-26)22(28)29-17-9-6-15(7-10-17)21(27)24-2/h3,6-12,14H,4-5H2,1-2H3,(H,24,27)