1-(azepan-1-yl)-3-[4-(2-phenylpropan-2-yl)phenoxy]propan-2-ol

Systemtic Name: 1-(azepan-1-yl)-3-[4-(2-phenylpropan-2-yl)phenoxy]propan-2-ol Openeye Name: 1-(azepan-1-yl)-3-[4-(1-methyl-1-phenyl-ethyl)phenoxy]propan-2-ol CAS Name: 1-(1-azepanyl)-3-[4-(2-phenylpropan-2-yl)phenoxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[4-(2-phenylpropan-2-yl)phenoxy]propan-2-ol Traditional Name: 1-(azepan-1-yl)-3-(4-cumylphenoxy)propan-2-ol Formula: C24H33NO2 MolecularWeight: 367.52432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC(CN3CCCCCC3)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC(CN3CCCCCC3)O

InChI

InChI=1S/C24H33NO2/c1-24(2,20-10-6-5-7-11-20)21-12-14-23(15-13-21)27-19-22(26)18-25-16-8-3-4-9-17-25/h5-7,10-15,22,26H,3-4,8-9,16-19H2,1-2H3