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

Systemtic Name: 1-[2-[2,4-bis(chloranyl)phenoxy]ethyl]-3-propyl-benzimidazol-3-ium-2-amine Openeye Name: 1-[2-(2,4-dichlorophenoxy)ethyl]-3-propyl-benzimidazol-3-ium-2-amine CAS Name: 1-[2-(2,4-dichlorophenoxy)ethyl]-3-propyl-2-benzimidazol-3-iumamine IUPAC Name: 1-[2-(2,4-dichlorophenoxy)ethyl]-3-propylbenzimidazol-3-ium-2-amine Traditional Name: [1-[2-(2,4-dichlorophenoxy)ethyl]-3-propyl-benzimidazol-3-ium-2-yl]amine Formula: C18H20Cl2N3O+ MolecularWeight: 365.2769

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19Cl2N3O/c1-2-9-22-15-5-3-4-6-16(15)23(18(22)21)10-11-24-17-8-7-13(19)12-14(17)20/h3-8,12,21H,2,9-11H2,1H3/p+1