1-pentyl-3-(2-phenoxyethyl)benzimidazol-1-ium-2-amine

Systemtic Name: 1-pentyl-3-(2-phenoxyethyl)benzimidazol-1-ium-2-amine Openeye Name: 1-pentyl-3-(2-phenoxyethyl)benzimidazol-1-ium-2-amine CAS Name: 1-pentyl-3-(2-phenoxyethyl)-2-benzimidazol-1-iumamine IUPAC Name: 1-pentyl-3-(2-phenoxyethyl)benzimidazol-1-ium-2-amine Traditional Name: [1-amyl-3-(2-phenoxyethyl)benzimidazol-1-ium-2-yl]amine Formula: C20H26N3O+ MolecularWeight: 324.43994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1=C(N(C2=CC=CC=C21)CCOC3=CC=CC=C3)N

Isomeric SMILES

CCCCC[N+]1=C(N(C2=CC=CC=C21)CCOC3=CC=CC=C3)N

InChI

InChI=1S/C20H25N3O/c1-2-3-9-14-22-18-12-7-8-13-19(18)23(20(22)21)15-16-24-17-10-5-4-6-11-17/h4-8,10-13,21H,2-3,9,14-16H2,1H3/p+1