1-[2-(2-methylphenoxy)ethyl]-3-propyl-benzimidazol-3-ium-2-amine

Systemtic Name: 1-[2-(2-methylphenoxy)ethyl]-3-propyl-benzimidazol-3-ium-2-amine Openeye Name: 1-[2-(2-methylphenoxy)ethyl]-3-propyl-benzimidazol-3-ium-2-amine CAS Name: 1-[2-(2-methylphenoxy)ethyl]-3-propyl-2-benzimidazol-3-iumamine IUPAC Name: 1-[2-(2-methylphenoxy)ethyl]-3-propylbenzimidazol-3-ium-2-amine Traditional Name: [1-[2-(2-methylphenoxy)ethyl]-3-propyl-benzimidazol-3-ium-2-yl]amine Formula: C19H24N3O+ MolecularWeight: 310.41336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(N(C2=CC=CC=C21)CCOC3=CC=CC=C3C)N

Isomeric SMILES

CCC[N+]1=C(N(C2=CC=CC=C21)CCOC3=CC=CC=C3C)N

InChI

InChI=1S/C19H23N3O/c1-3-12-21-16-9-5-6-10-17(16)22(19(21)20)13-14-23-18-11-7-4-8-15(18)2/h4-11,20H,3,12-14H2,1-2H3/p+1