ethyl 1-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3,5-dimethyl-1-phenylpyrazole-4-carbonyl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)oxyacetyl]isonipecotic acid ethyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H27N3O5/c1-4-29-21(27)17-10-12-24(13-11-17)19(26)14-30-22(28)20-15(2)23-25(16(20)3)18-8-6-5-7-9-18/h5-9,17H,4,10-14H2,1-3H3