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

Systemtic Name: ethyl 4-[2-(3-chlorophenyl)-5-(2,4-dimethoxyphenyl)pyrazol-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3-chlorophenyl)-5-(2,4-dimethoxyphenyl)pyrazole-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-(3-chlorophenyl)-5-(2,4-dimethoxyphenyl)-3-pyrazolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-chlorophenyl)-5-(2,4-dimethoxyphenyl)pyrazole-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-(3-chlorophenyl)-5-(2,4-dimethoxyphenyl)pyrazole-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H27ClN4O5 MolecularWeight: 498.95868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27ClN4O5/c1-4-35-25(32)29-12-10-28(11-13-29)24(31)22-16-21(20-9-8-19(33-2)15-23(20)34-3)27-30(22)18-7-5-6-17(26)14-18/h5-9,14-16H,4,10-13H2,1-3H3