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

Systemtic Name: 1-[2-[2,4-bis(chloranyl)phenoxy]ethyl]-3-methyl-benzimidazol-3-ium-2-amine Openeye Name: 1-[2-(2,4-dichlorophenoxy)ethyl]-3-methyl-benzimidazol-3-ium-2-amine CAS Name: 1-[2-(2,4-dichlorophenoxy)ethyl]-3-methyl-2-benzimidazol-3-iumamine IUPAC Name: 1-[2-(2,4-dichlorophenoxy)ethyl]-3-methylbenzimidazol-3-ium-2-amine Traditional Name: [1-[2-(2,4-dichlorophenoxy)ethyl]-3-methyl-benzimidazol-3-ium-2-yl]amine Formula: C16H16Cl2N3O+ MolecularWeight: 337.22374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15Cl2N3O/c1-20-13-4-2-3-5-14(13)21(16(20)19)8-9-22-15-7-6-11(17)10-12(15)18/h2-7,10,19H,8-9H2,1H3/p+1