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

Systemtic Name: ethyl 4-[[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[5-chloro-1-(4-fluorophenyl)-3-methylpyrazole-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C19H22ClFN4O3 MolecularWeight: 408.854383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C19H22ClFN4O3/c1-3-28-19(27)24-10-8-14(9-11-24)22-18(26)16-12(2)23-25(17(16)20)15-6-4-13(21)5-7-15/h4-7,14H,3,8-11H2,1-2H3,(H,22,26)