ethyl 4-[2-(3-chlorophenyl)-5-phenyl-pyrazol-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(3-chlorophenyl)-5-phenyl-pyrazol-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3-chlorophenyl)-5-phenyl-pyrazole-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-(3-chlorophenyl)-5-phenyl-3-pyrazolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-chlorophenyl)-5-phenylpyrazole-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-(3-chlorophenyl)-5-phenyl-pyrazole-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H23ClN4O3 MolecularWeight: 438.90672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H23ClN4O3/c1-2-31-23(30)27-13-11-26(12-14-27)22(29)21-16-20(17-7-4-3-5-8-17)25-28(21)19-10-6-9-18(24)15-19/h3-10,15-16H,2,11-14H2,1H3