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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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