ethyl 4-phenethyl-1-pyrazolo[1,5-a]pyrimidin-3-ylcarbonyl-piperidine-4-carboxylate

Systemtic Name: ethyl 4-phenethyl-1-pyrazolo[1,5-a]pyrimidin-3-ylcarbonyl-piperidine-4-carboxylate Openeye Name: ethyl 4-phenethyl-1-(pyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidine-4-carboxylate CAS Name: 1-[oxo(3-pyrazolo[1,5-a]pyrimidinyl)methyl]-4-phenethyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenethyl-1-(pyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidine-4-carboxylate Traditional Name: 4-phenethyl-1-(pyrazolo[1,5-a]pyrimidine-3-carbonyl)isonipecotic acid ethyl ester Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=C3N=CC=CN3N=C2)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=C3N=CC=CN3N=C2)CCC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O3/c1-2-30-22(29)23(10-9-18-7-4-3-5-8-18)11-15-26(16-12-23)21(28)19-17-25-27-14-6-13-24-20(19)27/h3-8,13-14,17H,2,9-12,15-16H2,1H3