ethyl 1-[2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carbonyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[3-(4-chlorophenyl)-1-phenylpyrazole-4-carbonyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carbonyl]oxyacetyl]isonipecotic acid ethyl ester Formula: C26H26ClN3O5 MolecularWeight: 495.95474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C26H26ClN3O5/c1-2-34-25(32)19-12-14-29(15-13-19)23(31)17-35-26(33)22-16-30(21-6-4-3-5-7-21)28-24(22)18-8-10-20(27)11-9-18/h3-11,16,19H,2,12-15,17H2,1H3