(2S)-1-(azocan-1-yl)-3-[2-methoxy-4-[(phenethylamino)methyl]phenoxy]propan-2-ol

Systemtic Name: (2S)-1-(azocan-1-yl)-3-[2-methoxy-4-[(phenethylamino)methyl]phenoxy]propan-2-ol Openeye Name: (2S)-1-(azocan-1-yl)-3-[2-methoxy-4-[(phenethylamino)methyl]phenoxy]propan-2-ol CAS Name: (2S)-1-(1-azocanyl)-3-[2-methoxy-4-[(phenethylamino)methyl]phenoxy]-2-propanol IUPAC Name: (2S)-1-(azocan-1-yl)-3-[2-methoxy-4-[(phenethylamino)methyl]phenoxy]propan-2-ol Traditional Name: (2S)-1-(azocan-1-yl)-3-[2-methoxy-4-[(phenethylamino)methyl]phenoxy]propan-2-ol Formula: C26H38N2O3 MolecularWeight: 426.59152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H38N2O3/c1-30-26-18-23(19-27-15-14-22-10-6-5-7-11-22)12-13-25(26)31-21-24(29)20-28-16-8-3-2-4-9-17-28/h5-7,10-13,18,24,27,29H,2-4,8-9,14-17,19-21H2,1H3/t24-/m0/s1