ethyl 1-[1-(4-fluorophenyl)-5-methyl-3-(2-methylpropyl)pyrazol-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(4-fluorophenyl)-5-methyl-3-(2-methylpropyl)pyrazol-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-(4-fluorophenyl)-3-isobutyl-5-methyl-pyrazole-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-(4-fluorophenyl)-5-methyl-3-(2-methylpropyl)-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-fluorophenyl)-5-methyl-3-(2-methylpropyl)pyrazole-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-(4-fluorophenyl)-3-isobutyl-5-methyl-pyrazole-4-carbonyl]nipecotic acid ethyl ester Formula: C23H30FN3O3 MolecularWeight: 415.501003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2CC(C)C)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2CC(C)C)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C23H30FN3O3/c1-5-30-23(29)17-7-6-12-26(14-17)22(28)21-16(4)27(25-20(21)13-15(2)3)19-10-8-18(24)9-11-19/h8-11,15,17H,5-7,12-14H2,1-4H3