[1-(decoxymethyl)-3-(phenylmethyl)benzimidazol-3-ium-2-yl]-phenyl-methanol chloride

Systemtic Name: [1-(decoxymethyl)-3-(phenylmethyl)benzimidazol-3-ium-2-yl]-phenyl-methanol chloride Openeye Name: [1-benzyl-3-(decoxymethyl)benzimidazol-1-ium-2-yl]-phenyl-methanol chloride CAS Name: [1-(decoxymethyl)-3-(phenylmethyl)-2-benzimidazol-3-iumyl]-phenylmethanol chloride IUPAC Name: [1-benzyl-3-(decoxymethyl)benzimidazol-1-ium-2-yl]-phenylmethanol chloride Traditional Name: [1-benzyl-3-(decoxymethyl)benzimidazol-1-ium-2-yl]-phenyl-methanol chloride Formula: C32H41ClN2O2 MolecularWeight: 521.13314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1C(C3=CC=CC=C3)O)CC4=CC=CC=C4.[Cl-]

Isomeric SMILES

CCCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1C(C3=CC=CC=C3)O)CC4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C32H41N2O2.ClH/c1-2-3-4-5-6-7-8-17-24-36-26-34-30-23-16-15-22-29(30)33(25-27-18-11-9-12-19-27)32(34)31(35)28-20-13-10-14-21-28;/h9-16,18-23,31,35H,2-8,17,24-26H2,1H3;1H/q+1;/p-1