(3R,4R)-4-(4-oxidanylpiperidin-1-yl)-1-[(4-pyrimidin-2-yloxyphenyl)methyl]piperidin-3-ol

Systemtic Name: (3R,4R)-4-(4-oxidanylpiperidin-1-yl)-1-[(4-pyrimidin-2-yloxyphenyl)methyl]piperidin-3-ol Openeye Name: (3R,4R)-4-(4-hydroxy-1-piperidyl)-1-[(4-pyrimidin-2-yloxyphenyl)methyl]piperidin-3-ol CAS Name: (3R,4R)-4-(4-hydroxy-1-piperidinyl)-1-[[4-(2-pyrimidinyloxy)phenyl]methyl]-3-piperidinol IUPAC Name: (3R,4R)-4-(4-hydroxypiperidin-1-yl)-1-[(4-pyrimidin-2-yloxyphenyl)methyl]piperidin-3-ol Traditional Name: (3R,4R)-4-(4-hydroxypiperidino)-1-[4-(2-pyrimidyloxy)benzyl]piperidin-3-ol Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C2CCN(CC2O)CC3=CC=C(C=C3)OC4=NC=CC=N4

Isomeric SMILES

C1CN(C[C@H]([C@@H]1N2CCC(CC2)O)O)CC3=CC=C(C=C3)OC4=NC=CC=N4

InChI

InChI=1S/C21H28N4O3/c26-17-6-12-25(13-7-17)19-8-11-24(15-20(19)27)14-16-2-4-18(5-3-16)28-21-22-9-1-10-23-21/h1-5,9-10,17,19-20,26-27H,6-8,11-15H2/t19-,20-/m1/s1