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

Systemtic Name: (2S)-1-(azepan-1-yl)-3-[4-[(cycloheptylamino)methyl]-2-methoxy-phenoxy]propan-2-ol Openeye Name: (2S)-1-(azepan-1-yl)-3-[4-[(cycloheptylamino)methyl]-2-methoxy-phenoxy]propan-2-ol CAS Name: (2S)-1-(1-azepanyl)-3-[4-[(cycloheptylamino)methyl]-2-methoxyphenoxy]-2-propanol IUPAC Name: (2S)-1-(azepan-1-yl)-3-[4-[(cycloheptylamino)methyl]-2-methoxyphenoxy]propan-2-ol Traditional Name: (2S)-1-(azepan-1-yl)-3-[4-[(cycloheptylamino)methyl]-2-methoxy-phenoxy]propan-2-ol Formula: C24H40N2O3 MolecularWeight: 404.586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2CCCCCC2)OCC(CN3CCCCCC3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2CCCCCC2)OC[C@H](CN3CCCCCC3)O

InChI

InChI=1S/C24H40N2O3/c1-28-24-16-20(17-25-21-10-6-2-3-7-11-21)12-13-23(24)29-19-22(27)18-26-14-8-4-5-9-15-26/h12-13,16,21-22,25,27H,2-11,14-15,17-19H2,1H3/t22-/m0/s1