ethyl 1-[2-[4-(pyrazol-1-ylmethyl)phenyl]carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[4-(pyrazol-1-ylmethyl)phenyl]carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[4-(pyrazol-1-ylmethyl)benzoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[oxo-[4-(1-pyrazolylmethyl)phenyl]methoxy]ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[4-(pyrazol-1-ylmethyl)benzoyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[4-(pyrazol-1-ylmethyl)benzoyl]oxyacetyl]isonipecotic acid ethyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C21H25N3O5/c1-2-28-20(26)18-8-12-23(13-9-18)19(25)15-29-21(27)17-6-4-16(5-7-17)14-24-11-3-10-22-24/h3-7,10-11,18H,2,8-9,12-15H2,1H3