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1-(pentoxymethyl)-3-(phenylmethyl)benzimidazol-3-ium chloride

1-(pentoxymethyl)-3-(phenylmethyl)benzimidazol-3-ium chloride

Systemtic Name:1-(pentoxymethyl)-3-(phenylmethyl)benzimidazol-3-ium chloride
Openeye Name:1-benzyl-3-(pentoxymethyl)benzimidazol-1-ium chloride
CAS Name:1-(pentoxymethyl)-3-(phenylmethyl)benzimidazol-3-ium chloride
IUPAC Name:1-benzyl-3-(pentoxymethyl)benzimidazol-1-ium chloride
Traditional Name:1-(amoxymethyl)-3-benzyl-benzimidazol-3-ium chloride
Formula: C20H25ClN2O
MolecularWeight: 344.8783
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOCN1C=[N+](C2=CC=CC=C21)CC3=CC=CC=C3.[Cl-]


Isomeric SMILES

CCCCCOCN1C=[N+](C2=CC=CC=C21)CC3=CC=CC=C3.[Cl-]


InChI

InChI=1S/C20H25N2O.ClH/c1-2-3-9-14-23-17-22-16-21(15-18-10-5-4-6-11-18)19-12-7-8-13-20(19)22;/h4-8,10-13,16H,2-3,9,14-15,17H2,1H3;1H/q+1;/p-1


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