1-(1-methylazepan-1-ium-1-yl)-3-naphthalen-1-yloxy-propan-2-ol

Systemtic Name: 1-(1-methylazepan-1-ium-1-yl)-3-naphthalen-1-yloxy-propan-2-ol Openeye Name: 1-(1-methylazepan-1-ium-1-yl)-3-(1-naphthyloxy)propan-2-ol CAS Name: 1-(1-methyl-1-azepan-1-iumyl)-3-(1-naphthalenyloxy)-2-propanol IUPAC Name: 1-(1-methylazepan-1-ium-1-yl)-3-naphthalen-1-yloxypropan-2-ol Traditional Name: 1-(1-methylazepan-1-ium-1-yl)-3-(1-naphthoxy)propan-2-ol Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCCC1)CC(COC2=CC=CC3=CC=CC=C32)O

Isomeric SMILES

C[N+]1(CCCCCC1)CC(COC2=CC=CC3=CC=CC=C32)O

InChI

InChI=1S/C20H28NO2/c1-21(13-6-2-3-7-14-21)15-18(22)16-23-20-12-8-10-17-9-4-5-11-19(17)20/h4-5,8-12,18,22H,2-3,6-7,13-16H2,1H3/q+1