1-[(4-chlorophenyl)methyl]-3-dodecyl-benzimidazol-1-ium-2-amine

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-dodecyl-benzimidazol-1-ium-2-amine Openeye Name: 1-[(4-chlorophenyl)methyl]-3-dodecyl-benzimidazol-1-ium-2-amine CAS Name: 1-[(4-chlorophenyl)methyl]-3-dodecyl-2-benzimidazol-1-iumamine IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-dodecylbenzimidazol-1-ium-2-amine Traditional Name: [1-(4-chlorobenzyl)-3-lauryl-benzimidazol-1-ium-2-yl]amine Formula: C26H37ClN3+ MolecularWeight: 427.04508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C2=CC=CC=C2[N+](=C1N)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCCCCCCCCN1C2=CC=CC=C2[N+](=C1N)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H36ClN3/c1-2-3-4-5-6-7-8-9-10-13-20-29-24-14-11-12-15-25(24)30(26(29)28)21-22-16-18-23(27)19-17-22/h11-12,14-19,28H,2-10,13,20-21H2,1H3/p+1