ethyl 1-[2-(3-chlorophenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(3-chlorophenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[2-(3-chlorophenyl)-5-(4-methoxyphenyl)pyrazole-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[2-(3-chlorophenyl)-5-(4-methoxyphenyl)-3-pyrazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-chlorophenyl)-5-(4-methoxyphenyl)pyrazole-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-chlorophenyl)-5-(4-methoxyphenyl)pyrazole-3-carbonyl]isonipecotic acid ethyl ester Formula: C25H26ClN3O4 MolecularWeight: 467.94464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NN2C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H26ClN3O4/c1-3-33-25(31)18-11-13-28(14-12-18)24(30)23-16-22(17-7-9-21(32-2)10-8-17)27-29(23)20-6-4-5-19(26)15-20/h4-10,15-16,18H,3,11-14H2,1-2H3