[[2-[2-methoxy-2-(pyrimidin-2-ylamino)piperidin-1-yl]phenyl]carbonylamino] propanoate

Systemtic Name: [[2-[2-methoxy-2-(pyrimidin-2-ylamino)piperidin-1-yl]phenyl]carbonylamino] propanoate Openeye Name: [[2-[2-methoxy-2-(pyrimidin-2-ylamino)-1-piperidyl]benzoyl]amino] propanoate CAS Name: propanoic acid [[[2-[2-methoxy-2-(2-pyrimidinylamino)-1-piperidinyl]phenyl]-oxomethyl]amino] ester IUPAC Name: [[2-[2-methoxy-2-(pyrimidin-2-ylamino)piperidin-1-yl]benzoyl]amino] propanoate Traditional Name: propionic acid [[2-[2-methoxy-2-(2-pyrimidylamino)piperidino]benzoyl]amino] ester Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ONC(=O)C1=CC=CC=C1N2CCCCC2(NC3=NC=CC=N3)OC

Isomeric SMILES

CCC(=O)ONC(=O)C1=CC=CC=C1N2CCCCC2(NC3=NC=CC=N3)OC

InChI

InChI=1S/C20H25N5O4/c1-3-17(26)29-24-18(27)15-9-4-5-10-16(15)25-14-7-6-11-20(25,28-2)23-19-21-12-8-13-22-19/h4-5,8-10,12-13H,3,6-7,11,14H2,1-2H3,(H,24,27)(H,21,22,23)