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

Systemtic Name: ethyl 1-[5-(2,4-dimethoxyphenyl)-2-phenyl-pyrazol-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-(2,4-dimethoxyphenyl)-2-phenyl-pyrazole-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[5-(2,4-dimethoxyphenyl)-2-phenyl-3-pyrazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(2,4-dimethoxyphenyl)-2-phenylpyrazole-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[5-(2,4-dimethoxyphenyl)-2-phenyl-pyrazole-3-carbonyl]isonipecotic acid ethyl ester Formula: C26H29N3O5 MolecularWeight: 463.52556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N3O5/c1-4-34-26(31)18-12-14-28(15-13-18)25(30)23-17-22(27-29(23)19-8-6-5-7-9-19)21-11-10-20(32-2)16-24(21)33-3/h5-11,16-18H,4,12-15H2,1-3H3