N-methyl-2-[3-(6-phenylhexoxy)propyl]-3-phenylmethoxy-pyridin-1-ium-1-amine

Systemtic Name: N-methyl-2-[3-(6-phenylhexoxy)propyl]-3-phenylmethoxy-pyridin-1-ium-1-amine Openeye Name: 3-benzyloxy-N-methyl-2-[3-(6-phenylhexoxy)propyl]pyridin-1-ium-1-amine CAS Name: N-methyl-2-[3-(6-phenylhexoxy)propyl]-3-phenylmethoxy-1-pyridin-1-iumamine IUPAC Name: N-methyl-2-[3-(6-phenylhexoxy)propyl]-3-phenylmethoxypyridin-1-ium-1-amine Traditional Name: [3-benzoxy-2-[3-(6-phenylhexoxy)propyl]pyridin-1-ium-1-yl]-methyl-amine Formula: C28H37N2O2+ MolecularWeight: 433.60558

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Descriptors Computed from Structure

Canonical SMILES:

CN[N+]1=CC=CC(=C1CCCOCCCCCCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CN[N+]1=CC=CC(=C1CCCOCCCCCCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C28H37N2O2/c1-29-30-21-12-20-28(32-24-26-17-9-5-10-18-26)27(30)19-13-23-31-22-11-3-2-6-14-25-15-7-4-8-16-25/h4-5,7-10,12,15-18,20-21,29H,2-3,6,11,13-14,19,22-24H2,1H3/q+1