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

Systemtic Name: ethyl 2-[2-azanyl-3-(2-diethylaminoethyl)benzimidazol-1-ium-1-yl]ethanoate Openeye Name: ethyl 2-[2-amino-3-(2-diethylaminoethyl)benzimidazol-1-ium-1-yl]acetate CAS Name: 2-[2-amino-3-(2-diethylaminoethyl)-1-benzimidazol-1-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-amino-3-(2-diethylaminoethyl)benzimidazol-1-ium-1-yl]acetate Traditional Name: 2-[2-amino-3-(2-diethylaminoethyl)benzimidazol-1-ium-1-yl]acetic acid ethyl ester Formula: C17H27N4O2+ MolecularWeight: 319.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)OCC

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)OCC

InChI

InChI=1S/C17H26N4O2/c1-4-19(5-2)11-12-20-14-9-7-8-10-15(14)21(17(20)18)13-16(22)23-6-3/h7-10,18H,4-6,11-13H2,1-3H3/p+1