ethyl 2-[2-azanyl-3-[2-(2-chloranylphenoxy)ethyl]benzimidazol-1-ium-1-yl]ethanoate

Systemtic Name: ethyl 2-[2-azanyl-3-[2-(2-chloranylphenoxy)ethyl]benzimidazol-1-ium-1-yl]ethanoate Openeye Name: ethyl 2-[2-amino-3-[2-(2-chlorophenoxy)ethyl]benzimidazol-1-ium-1-yl]acetate CAS Name: 2-[2-amino-3-[2-(2-chlorophenoxy)ethyl]-1-benzimidazol-1-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-amino-3-[2-(2-chlorophenoxy)ethyl]benzimidazol-1-ium-1-yl]acetate Traditional Name: 2-[2-amino-3-[2-(2-chlorophenoxy)ethyl]benzimidazol-1-ium-1-yl]acetic acid ethyl ester Formula: C19H21ClN3O3+ MolecularWeight: 374.84134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=C(N(C2=CC=CC=C21)CCOC3=CC=CC=C3Cl)N

Isomeric SMILES

CCOC(=O)C[N+]1=C(N(C2=CC=CC=C21)CCOC3=CC=CC=C3Cl)N

InChI

InChI=1S/C19H20ClN3O3/c1-2-25-18(24)13-23-16-9-5-4-8-15(16)22(19(23)21)11-12-26-17-10-6-3-7-14(17)20/h3-10,21H,2,11-13H2,1H3/p+1