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

Systemtic Name: ethyl 2-[2-azanyl-3-(2-dimethylaminoethyl)benzimidazol-1-ium-1-yl]ethanoate Openeye Name: ethyl 2-[2-amino-3-(2-dimethylaminoethyl)benzimidazol-1-ium-1-yl]acetate CAS Name: 2-[2-amino-3-(2-dimethylaminoethyl)-1-benzimidazol-1-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-amino-3-(2-dimethylaminoethyl)benzimidazol-1-ium-1-yl]acetate Traditional Name: 2-[2-amino-3-(2-dimethylaminoethyl)benzimidazol-1-ium-1-yl]acetic acid ethyl ester Formula: C15H23N4O2+ MolecularWeight: 291.36872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N4O2/c1-4-21-14(20)11-19-13-8-6-5-7-12(13)18(15(19)16)10-9-17(2)3/h5-8,16H,4,9-11H2,1-3H3/p+1