1-[2-[2,4-bis(chloranyl)phenoxy]ethyl]-3-butyl-benzimidazol-3-ium-2-amine

Systemtic Name: 1-[2-[2,4-bis(chloranyl)phenoxy]ethyl]-3-butyl-benzimidazol-3-ium-2-amine Openeye Name: 1-butyl-3-[2-(2,4-dichlorophenoxy)ethyl]benzimidazol-1-ium-2-amine CAS Name: 1-butyl-3-[2-(2,4-dichlorophenoxy)ethyl]-2-benzimidazol-1-iumamine IUPAC Name: 1-butyl-3-[2-(2,4-dichlorophenoxy)ethyl]benzimidazol-1-ium-2-amine Traditional Name: [1-butyl-3-[2-(2,4-dichlorophenoxy)ethyl]benzimidazol-1-ium-2-yl]amine Formula: C19H22Cl2N3O+ MolecularWeight: 379.30348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21Cl2N3O/c1-2-3-10-23-16-6-4-5-7-17(16)24(19(23)22)11-12-25-18-9-8-14(20)13-15(18)21/h4-9,13,22H,2-3,10-12H2,1H3/p+1