(3R,4R)-1-(isoquinolin-5-ylmethyl)-4-(4-oxidanylpiperidin-1-yl)piperidin-3-ol

Systemtic Name: (3R,4R)-1-(isoquinolin-5-ylmethyl)-4-(4-oxidanylpiperidin-1-yl)piperidin-3-ol Openeye Name: (3R,4R)-4-(4-hydroxy-1-piperidyl)-1-(5-isoquinolylmethyl)piperidin-3-ol CAS Name: (3R,4R)-4-(4-hydroxy-1-piperidinyl)-1-(5-isoquinolinylmethyl)-3-piperidinol IUPAC Name: (3R,4R)-4-(4-hydroxypiperidin-1-yl)-1-(isoquinolin-5-ylmethyl)piperidin-3-ol Traditional Name: (3R,4R)-4-(4-hydroxypiperidino)-1-(5-isoquinolylmethyl)piperidin-3-ol Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C2CCN(CC2O)CC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CN(C[C@H]([C@@H]1N2CCC(CC2)O)O)CC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C20H27N3O2/c24-17-5-10-23(11-6-17)19-7-9-22(14-20(19)25)13-16-3-1-2-15-12-21-8-4-18(15)16/h1-4,8,12,17,19-20,24-25H,5-7,9-11,13-14H2/t19-,20-/m1/s1