ethyl 2-[3-(phenylmethyl)benzimidazol-3-ium-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-(phenylmethyl)benzimidazol-3-ium-1-yl]ethanoate Openeye Name: ethyl 2-(3-benzylbenzimidazol-3-ium-1-yl)acetate CAS Name: 2-[3-(phenylmethyl)-1-benzimidazol-3-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(3-benzylbenzimidazol-3-ium-1-yl)acetate Traditional Name: 2-(3-benzylbenzimidazol-3-ium-1-yl)acetic acid ethyl ester Formula: C18H19N2O2+ MolecularWeight: 295.35566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=[N+](C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN1C=[N+](C2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C18H19N2O2/c1-2-22-18(21)13-20-14-19(12-15-8-4-3-5-9-15)16-10-6-7-11-17(16)20/h3-11,14H,2,12-13H2,1H3/q+1