2-[2-azanyl-3-[2-(3-methylphenoxy)ethyl]benzimidazol-1-ium-1-yl]ethanol

Systemtic Name: 2-[2-azanyl-3-[2-(3-methylphenoxy)ethyl]benzimidazol-1-ium-1-yl]ethanol Openeye Name: 2-[2-amino-3-[2-(3-methylphenoxy)ethyl]benzimidazol-1-ium-1-yl]ethanol CAS Name: 2-[2-amino-3-[2-(3-methylphenoxy)ethyl]-1-benzimidazol-1-iumyl]ethanol IUPAC Name: 2-[2-amino-3-[2-(3-methylphenoxy)ethyl]benzimidazol-1-ium-1-yl]ethanol Traditional Name: 2-[2-amino-3-[2-(3-methylphenoxy)ethyl]benzimidazol-1-ium-1-yl]ethanol Formula: C18H22N3O2+ MolecularWeight: 312.38618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCN2C3=CC=CC=C3[N+](=C2N)CCO

Isomeric SMILES

CC1=CC(=CC=C1)OCCN2C3=CC=CC=C3[N+](=C2N)CCO

InChI

InChI=1S/C18H21N3O2/c1-14-5-4-6-15(13-14)23-12-10-21-17-8-3-2-7-16(17)20(9-11-22)18(21)19/h2-8,13,19,22H,9-12H2,1H3/p+1