methyl 1-[2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoyloxy]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoyloxy]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxoethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetyl]oxyacetyl]isonipecotic acid methyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)OCC(=O)N3CCC(CC3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)OCC(=O)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C22H27N3O5/c1-15-19(16(2)25(23-15)18-7-5-4-6-8-18)13-21(27)30-14-20(26)24-11-9-17(10-12-24)22(28)29-3/h4-8,17H,9-14H2,1-3H3