2-[2-[(2-methoxyphenoxy)methyl]-3-methyl-benzimidazol-3-ium-1-yl]ethanoate

Systemtic Name: 2-[2-[(2-methoxyphenoxy)methyl]-3-methyl-benzimidazol-3-ium-1-yl]ethanoate Openeye Name: 2-[2-[(2-methoxyphenoxy)methyl]-3-methyl-benzimidazol-3-ium-1-yl]acetate CAS Name: 2-[2-[(2-methoxyphenoxy)methyl]-3-methyl-1-benzimidazol-3-iumyl]acetate IUPAC Name: 2-[2-[(2-methoxyphenoxy)methyl]-3-methylbenzimidazol-3-ium-1-yl]acetate Traditional Name: 2-[2-[(2-methoxyphenoxy)methyl]-3-methyl-benzimidazol-3-ium-1-yl]acetate Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(N(C2=CC=CC=C21)CC(=O)[O-])COC3=CC=CC=C3OC

Isomeric SMILES

C[N+]1=C(N(C2=CC=CC=C21)CC(=O)[O-])COC3=CC=CC=C3OC

InChI

InChI=1S/C18H18N2O4/c1-19-13-7-3-4-8-14(13)20(11-18(21)22)17(19)12-24-16-10-6-5-9-15(16)23-2/h3-10H,11-12H2,1-2H3