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1-(11-azanylundecyl)-3-(phenylmethyl)benzimidazol-3-ium-2-amine

1-(11-azanylundecyl)-3-(phenylmethyl)benzimidazol-3-ium-2-amine

Systemtic Name:1-(11-azanylundecyl)-3-(phenylmethyl)benzimidazol-3-ium-2-amine
Openeye Name:1-(11-aminoundecyl)-3-benzyl-benzimidazol-3-ium-2-amine
CAS Name:1-(11-aminoundecyl)-3-(phenylmethyl)-2-benzimidazol-3-iumamine
IUPAC Name:1-(11-aminoundecyl)-3-benzylbenzimidazol-3-ium-2-amine
Traditional Name:11-(2-amino-3-benzyl-benzimidazol-3-ium-1-yl)undecylamine
Formula: C25H37N4+
MolecularWeight: 393.58808
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(N(C3=CC=CC=C32)CCCCCCCCCCCN)N


Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(N(C3=CC=CC=C32)CCCCCCCCCCCN)N


InChI

InChI=1S/C25H36N4/c26-19-13-6-4-2-1-3-5-7-14-20-28-23-17-11-12-18-24(23)29(25(28)27)21-22-15-9-8-10-16-22/h8-12,15-18,27H,1-7,13-14,19-21,26H2/p+1


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