methyl 1-[2-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[1-benzyl-3-(2-thienyl)pyrazole-4-carbonyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[oxo-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]methoxy]ethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(1-benzyl-3-thiophen-2-ylpyrazole-4-carbonyl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[1-benzyl-3-(2-thienyl)pyrazole-4-carbonyl]oxyacetyl]isonipecotic acid methyl ester Formula: C24H25N3O5S MolecularWeight: 467.5374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O5S/c1-31-23(29)18-9-11-26(12-10-18)21(28)16-32-24(30)19-15-27(14-17-6-3-2-4-7-17)25-22(19)20-8-5-13-33-20/h2-8,13,15,18H,9-12,14,16H2,1H3