(2R)-1-(azocan-1-yl)-3-[5-methoxy-2-[(oxan-4-ylmethylamino)methyl]phenoxy]propan-2-ol

Systemtic Name: (2R)-1-(azocan-1-yl)-3-[5-methoxy-2-[(oxan-4-ylmethylamino)methyl]phenoxy]propan-2-ol Openeye Name: (2R)-1-(azocan-1-yl)-3-[5-methoxy-2-[(tetrahydropyran-4-ylmethylamino)methyl]phenoxy]propan-2-ol CAS Name: (2R)-1-(1-azocanyl)-3-[5-methoxy-2-[(4-oxanylmethylamino)methyl]phenoxy]-2-propanol IUPAC Name: (2R)-1-(azocan-1-yl)-3-[5-methoxy-2-[(oxan-4-ylmethylamino)methyl]phenoxy]propan-2-ol Traditional Name: (2R)-1-(azocan-1-yl)-3-[5-methoxy-2-[(tetrahydropyran-4-ylmethylamino)methyl]phenoxy]propan-2-ol Formula: C24H40N2O4 MolecularWeight: 420.5854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNCC2CCOCC2)OCC(CN3CCCCCCC3)O

Isomeric SMILES

COC1=CC(=C(C=C1)CNCC2CCOCC2)OC[C@@H](CN3CCCCCCC3)O

InChI

InChI=1S/C24H40N2O4/c1-28-23-8-7-21(17-25-16-20-9-13-29-14-10-20)24(15-23)30-19-22(27)18-26-11-5-3-2-4-6-12-26/h7-8,15,20,22,25,27H,2-6,9-14,16-19H2,1H3/t22-/m1/s1