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

Systemtic Name: methyl 1-[2-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(5-chloro-3-methyl-1-phenyl-pyrazole-4-carbonyl)oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(5-chloro-3-methyl-1-phenylpyrazole-4-carbonyl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(5-chloro-3-methyl-1-phenyl-pyrazole-4-carbonyl)oxyacetyl]isonipecotic acid methyl ester Formula: C20H22ClN3O5 MolecularWeight: 419.85878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC(=O)N2CCC(CC2)C(=O)OC)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC(=O)N2CCC(CC2)C(=O)OC)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H22ClN3O5/c1-13-17(18(21)24(22-13)15-6-4-3-5-7-15)20(27)29-12-16(25)23-10-8-14(9-11-23)19(26)28-2/h3-7,14H,8-12H2,1-2H3