ethyl 1-[2-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]carbonyloxy]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]carbonyloxy]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]oxyacetyl]isonipecotic acid ethyl ester Formula: C20H22BrN3O5 MolecularWeight: 464.30978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3O5/c1-2-28-19(26)14-7-9-24(10-8-14)18(25)12-29-20(27)17-11-16(22-23-17)13-3-5-15(21)6-4-13/h3-6,11,14H,2,7-10,12H2,1H3,(H,22,23)