(2R)-1-(azocan-1-yl)-3-[2-methoxy-4-[(2-pyridin-3-ylethylamino)methyl]phenoxy]propan-2-ol

Systemtic Name: (2R)-1-(azocan-1-yl)-3-[2-methoxy-4-[(2-pyridin-3-ylethylamino)methyl]phenoxy]propan-2-ol Openeye Name: (2R)-1-(azocan-1-yl)-3-[2-methoxy-4-[[2-(3-pyridyl)ethylamino]methyl]phenoxy]propan-2-ol CAS Name: (2R)-1-(1-azocanyl)-3-[2-methoxy-4-[[2-(3-pyridinyl)ethylamino]methyl]phenoxy]-2-propanol IUPAC Name: (2R)-1-(azocan-1-yl)-3-[2-methoxy-4-[(2-pyridin-3-ylethylamino)methyl]phenoxy]propan-2-ol Traditional Name: (2R)-1-(azocan-1-yl)-3-[2-methoxy-4-[[2-(3-pyridyl)ethylamino]methyl]phenoxy]propan-2-ol Formula: C25H37N3O3 MolecularWeight: 427.57958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNCCC2=CN=CC=C2)OCC(CN3CCCCCCC3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNCCC2=CN=CC=C2)OC[C@@H](CN3CCCCCCC3)O

InChI

InChI=1S/C25H37N3O3/c1-30-25-16-22(18-27-13-11-21-8-7-12-26-17-21)9-10-24(25)31-20-23(29)19-28-14-5-3-2-4-6-15-28/h7-10,12,16-17,23,27,29H,2-6,11,13-15,18-20H2,1H3/t23-/m1/s1