3-(2-diethylaminoethyl)benzimidazol-3-ium-1,2-diamine

Systemtic Name: 3-(2-diethylaminoethyl)benzimidazol-3-ium-1,2-diamine Openeye Name: 3-(2-diethylaminoethyl)benzimidazol-3-ium-1,2-diamine CAS Name: 3-(2-diethylaminoethyl)benzimidazol-3-ium-1,2-diamine IUPAC Name: 3-(2-diethylaminoethyl)benzimidazol-3-ium-1,2-diamine Traditional Name: 2-(2,3-diaminobenzimidazol-1-ium-1-yl)ethyl-diethyl-amine Formula: C13H22N5+ MolecularWeight: 248.34728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N5/c1-3-16(4-2)9-10-17-11-7-5-6-8-12(11)18(15)13(17)14/h5-8,14H,3-4,9-10,15H2,1-2H3/p+1