ethyl 2-(2-methyl-3-prop-2-enyl-benzimidazol-1-ium-1-yl)ethanoate

Systemtic Name: ethyl 2-(2-methyl-3-prop-2-enyl-benzimidazol-1-ium-1-yl)ethanoate Openeye Name: ethyl 2-(3-allyl-2-methyl-benzimidazol-1-ium-1-yl)acetate CAS Name: 2-(2-methyl-3-prop-2-enyl-1-benzimidazol-1-iumyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(2-methyl-3-prop-2-enylbenzimidazol-1-ium-1-yl)acetate Traditional Name: 2-(3-allyl-2-methyl-benzimidazol-1-ium-1-yl)acetic acid ethyl ester Formula: C15H19N2O2+ MolecularWeight: 259.32356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=C(N(C2=CC=CC=C21)CC=C)C

Isomeric SMILES

CCOC(=O)C[N+]1=C(N(C2=CC=CC=C21)CC=C)C

InChI

InChI=1S/C15H19N2O2/c1-4-10-16-12(3)17(11-15(18)19-5-2)14-9-7-6-8-13(14)16/h4,6-9H,1,5,10-11H2,2-3H3/q+1