ethyl 1-[7-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[7-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[7-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[7-(2-fluorophenyl)-3-pyrazolo[1,5-a]pyrimidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[7-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[7-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]nipecotic acid ethyl ester Formula: C21H21FN4O3 MolecularWeight: 396.414843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=C3N=CC=C(N3N=C2)C4=CC=CC=C4F

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=C3N=CC=C(N3N=C2)C4=CC=CC=C4F

InChI

InChI=1S/C21H21FN4O3/c1-2-29-21(28)14-6-5-11-25(13-14)20(27)16-12-24-26-18(9-10-23-19(16)26)15-7-3-4-8-17(15)22/h3-4,7-10,12,14H,2,5-6,11,13H2,1H3