2-[2-azanyl-3-(2-butoxy-2-oxidanylidene-ethyl)benzimidazol-3-ium-1-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[2-azanyl-3-(2-butoxy-2-oxidanylidene-ethyl)benzimidazol-3-ium-1-yl]ethyl-diethyl-azanium Openeye Name: 2-[2-amino-3-(2-butoxy-2-oxo-ethyl)benzimidazol-3-ium-1-yl]ethyl-diethyl-ammonium CAS Name: 2-[2-amino-3-(2-butoxy-2-oxoethyl)-1-benzimidazol-3-iumyl]ethyl-diethylammonium IUPAC Name: 2-[2-amino-3-(2-butoxy-2-oxoethyl)benzimidazol-3-ium-1-yl]ethyl-diethylazanium Traditional Name: 2-[2-amino-3-(2-butoxy-2-keto-ethyl)benzimidazol-3-ium-1-yl]ethyl-diethyl-ammonium Formula: C19H32N4O2+2 MolecularWeight: 348.48298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N4O2/c1-4-7-14-25-18(24)15-23-17-11-9-8-10-16(17)22(19(23)20)13-12-21(5-2)6-3/h8-11,20H,4-7,12-15H2,1-3H3/p+2