ethyl 5-(4-chlorophenyl)-1-[4-(cyclobutylcarbamoyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)-1-[4-(cyclobutylcarbamoyl)phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 5-(4-chlorophenyl)-1-[4-(cyclobutylcarbamoyl)phenyl]pyrazole-3-carboxylate CAS Name: 5-(4-chlorophenyl)-1-[4-[(cyclobutylamino)-oxomethyl]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-1-[4-(cyclobutylcarbamoyl)phenyl]pyrazole-3-carboxylate Traditional Name: 5-(4-chlorophenyl)-1-[4-(cyclobutylcarbamoyl)phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C23H22ClN3O3 MolecularWeight: 423.89208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C(=O)NC4CCC4

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C(=O)NC4CCC4

InChI

InChI=1S/C23H22ClN3O3/c1-2-30-23(29)20-14-21(15-6-10-17(24)11-7-15)27(26-20)19-12-8-16(9-13-19)22(28)25-18-4-3-5-18/h6-14,18H,2-5H2,1H3,(H,25,28)