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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1CCCN(C1)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)18-9-8-14-28(17-18)25(30)23-16-22(27-29(23)19-10-6-5-7-11-19)21-13-12-20(32-2)15-24(21)33-3/h5-7,10-13,15-16,18H,4,8-9,14,17H2,1-3H3