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

Systemtic Name: methyl 1-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O5/c1-14-19(15(2)24(22-14)17-7-5-4-6-8-17)21(27)29-13-18(25)23-11-9-16(10-12-23)20(26)28-3/h4-8,16H,9-13H2,1-3H3