methyl 1-[2-[4-(5-methylpyrazol-1-yl)phenyl]carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[4-(5-methylpyrazol-1-yl)phenyl]carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[4-(5-methylpyrazol-1-yl)benzoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[4-(5-methyl-1-pyrazolyl)phenyl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[4-(5-methylpyrazol-1-yl)benzoyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[4-(5-methylpyrazol-1-yl)benzoyl]oxyacetyl]isonipecotic acid methyl ester Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O5/c1-14-7-10-21-23(14)17-5-3-15(4-6-17)20(26)28-13-18(24)22-11-8-16(9-12-22)19(25)27-2/h3-7,10,16H,8-9,11-13H2,1-2H3