ethyl 1-[2-(4-methoxyphenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(4-methoxyphenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-methoxyphenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl]piperidine-4-carboxylate CAS Name: 1-[2-(4-methoxyphenyl)-5-phenyl-7-pyrazolo[1,5-a]pyrimidinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-methoxyphenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl]isonipecotic acid ethyl ester Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=CC(=NC3=CC(=NN32)C4=CC=C(C=C4)OC)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=CC(=NC3=CC(=NN32)C4=CC=C(C=C4)OC)C5=CC=CC=C5

InChI

InChI=1S/C27H28N4O3/c1-3-34-27(32)21-13-15-30(16-14-21)26-18-23(19-7-5-4-6-8-19)28-25-17-24(29-31(25)26)20-9-11-22(33-2)12-10-20/h4-12,17-18,21H,3,13-16H2,1-2H3