ethyl 1-[1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[1-(4-methoxyphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]isonipecotic acid ethyl ester Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC=NC3=C2C=NN3C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC=NC3=C2C=NN3C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H23N5O3/c1-3-28-20(26)14-8-10-24(11-9-14)18-17-12-23-25(19(17)22-13-21-18)15-4-6-16(27-2)7-5-15/h4-7,12-14H,3,8-11H2,1-2H3