1-[5-(azepan-1-ylmethyl)-2-methoxy-phenoxy]-3-[methyl-(phenylmethyl)amino]propan-2-ol

Systemtic Name: 1-[5-(azepan-1-ylmethyl)-2-methoxy-phenoxy]-3-[methyl-(phenylmethyl)amino]propan-2-ol Openeye Name: 1-[5-(azepan-1-ylmethyl)-2-methoxy-phenoxy]-3-[benzyl(methyl)amino]propan-2-ol CAS Name: 1-[5-(1-azepanylmethyl)-2-methoxyphenoxy]-3-[methyl-(phenylmethyl)amino]-2-propanol IUPAC Name: 1-[5-(azepan-1-ylmethyl)-2-methoxyphenoxy]-3-[benzyl(methyl)amino]propan-2-ol Traditional Name: 1-[5-(azepan-1-ylmethyl)-2-methoxy-phenoxy]-3-[benzyl(methyl)amino]propan-2-ol Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)CC(COC2=C(C=CC(=C2)CN3CCCCCC3)OC)O

Isomeric SMILES

CN(CC1=CC=CC=C1)CC(COC2=C(C=CC(=C2)CN3CCCCCC3)OC)O

InChI

InChI=1S/C25H36N2O3/c1-26(17-21-10-6-5-7-11-21)19-23(28)20-30-25-16-22(12-13-24(25)29-2)18-27-14-8-3-4-9-15-27/h5-7,10-13,16,23,28H,3-4,8-9,14-15,17-20H2,1-2H3