1-ethyl-3-(pentoxymethyl)-2-phenyl-imidazol-3-ium chloride

Systemtic Name: 1-ethyl-3-(pentoxymethyl)-2-phenyl-imidazol-3-ium chloride Openeye Name: 1-ethyl-3-(pentoxymethyl)-2-phenyl-imidazol-3-ium chloride CAS Name: 1-ethyl-3-(pentoxymethyl)-2-phenylimidazol-3-ium chloride IUPAC Name: 1-ethyl-3-(pentoxymethyl)-2-phenylimidazol-3-ium chloride Traditional Name: 1-(amoxymethyl)-3-ethyl-2-phenyl-imidazol-1-ium chloride Formula: C17H25ClN2O MolecularWeight: 308.8462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC[N+]1=C(N(C=C1)CC)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCCCCOC[N+]1=C(N(C=C1)CC)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C17H25N2O.ClH/c1-3-5-9-14-20-15-19-13-12-18(4-2)17(19)16-10-7-6-8-11-16;/h6-8,10-13H,3-5,9,14-15H2,1-2H3;1H/q+1;/p-1