ethyl 1-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-chloro-1-(4-fluorophenyl)-3-methylpyrazole-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carbonyl]nipecotic acid ethyl ester Formula: C19H21ClFN3O3 MolecularWeight: 393.839743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C19H21ClFN3O3/c1-3-27-19(26)13-5-4-10-23(11-13)18(25)16-12(2)22-24(17(16)20)15-8-6-14(21)7-9-15/h6-9,13H,3-5,10-11H2,1-2H3