1-(azocan-1-yl)-3-[4-[[(4,6-dimethylpyrimidin-2-yl)methylamino]methyl]-2-methoxy-phenoxy]propan-2-ol

Systemtic Name: 1-(azocan-1-yl)-3-[4-[[(4,6-dimethylpyrimidin-2-yl)methylamino]methyl]-2-methoxy-phenoxy]propan-2-ol Openeye Name: 1-(azocan-1-yl)-3-[4-[[(4,6-dimethylpyrimidin-2-yl)methylamino]methyl]-2-methoxy-phenoxy]propan-2-ol CAS Name: 1-(1-azocanyl)-3-[4-[[(4,6-dimethyl-2-pyrimidinyl)methylamino]methyl]-2-methoxyphenoxy]-2-propanol IUPAC Name: 1-(azocan-1-yl)-3-[4-[[(4,6-dimethylpyrimidin-2-yl)methylamino]methyl]-2-methoxyphenoxy]propan-2-ol Traditional Name: 1-(azocan-1-yl)-3-[4-[[(4,6-dimethylpyrimidin-2-yl)methylamino]methyl]-2-methoxy-phenoxy]propan-2-ol Formula: C25H38N4O3 MolecularWeight: 442.59422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)CNCC2=CC(=C(C=C2)OCC(CN3CCCCCCC3)O)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)CNCC2=CC(=C(C=C2)OCC(CN3CCCCCCC3)O)OC)C

InChI

InChI=1S/C25H38N4O3/c1-19-13-20(2)28-25(27-19)16-26-15-21-9-10-23(24(14-21)31-3)32-18-22(30)17-29-11-7-5-4-6-8-12-29/h9-10,13-14,22,26,30H,4-8,11-12,15-18H2,1-3H3