ethyl 1-[1-(2-chlorophenyl)-3,5-dipropyl-pyrazol-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(2-chlorophenyl)-3,5-dipropyl-pyrazol-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-(2-chlorophenyl)-3,5-dipropyl-pyrazole-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-(2-chlorophenyl)-3,5-dipropyl-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(2-chlorophenyl)-3,5-dipropylpyrazole-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-(2-chlorophenyl)-3,5-dipropyl-pyrazole-4-carbonyl]nipecotic acid ethyl ester Formula: C24H32ClN3O3 MolecularWeight: 445.98218

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C2=CC=CC=C2Cl)CCC)C(=O)N3CCCC(C3)C(=O)OCC

Isomeric SMILES

CCCC1=C(C(=NN1C2=CC=CC=C2Cl)CCC)C(=O)N3CCCC(C3)C(=O)OCC

InChI

InChI=1S/C24H32ClN3O3/c1-4-10-19-22(23(29)27-15-9-12-17(16-27)24(30)31-6-3)21(11-5-2)28(26-19)20-14-8-7-13-18(20)25/h7-8,13-14,17H,4-6,9-12,15-16H2,1-3H3