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

Systemtic Name: 1-(azepan-1-yl)-3-[4-[[2-(cyclohexen-1-yl)ethylamino]methyl]-2-methoxy-phenoxy]propan-2-ol Openeye Name: 1-(azepan-1-yl)-3-[4-[[2-(cyclohexen-1-yl)ethylamino]methyl]-2-methoxy-phenoxy]propan-2-ol CAS Name: 1-(1-azepanyl)-3-[4-[[2-(1-cyclohexenyl)ethylamino]methyl]-2-methoxyphenoxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[4-[[2-(cyclohexen-1-yl)ethylamino]methyl]-2-methoxyphenoxy]propan-2-ol Traditional Name: 1-(azepan-1-yl)-3-[4-[[2-(cyclohexen-1-yl)ethylamino]methyl]-2-methoxy-phenoxy]propan-2-ol Formula: C25H40N2O3 MolecularWeight: 416.5967

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNCCC2=CCCCC2)OCC(CN3CCCCCC3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNCCC2=CCCCC2)OCC(CN3CCCCCC3)O

InChI

InChI=1S/C25H40N2O3/c1-29-25-17-22(18-26-14-13-21-9-5-4-6-10-21)11-12-24(25)30-20-23(28)19-27-15-7-2-3-8-16-27/h9,11-12,17,23,26,28H,2-8,10,13-16,18-20H2,1H3