2-[2-(3-azaniumylpropyl)-5,6-dimethoxy-benzimidazol-1-yl]ethanoate

Systemtic Name: 2-[2-(3-azaniumylpropyl)-5,6-dimethoxy-benzimidazol-1-yl]ethanoate Openeye Name: 2-[2-(3-azaniumylpropyl)-5,6-dimethoxy-benzimidazol-1-yl]acetate CAS Name: 2-[2-(3-ammoniopropyl)-5,6-dimethoxy-1-benzimidazolyl]acetate IUPAC Name: 2-[2-(3-azaniumylpropyl)-5,6-dimethoxybenzimidazol-1-yl]acetate Traditional Name: 2-[2-(3-ammoniopropyl)-5,6-dimethoxy-benzimidazol-1-yl]acetate Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N2CC(=O)[O-])CCC[NH3+])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N2CC(=O)[O-])CCC[NH3+])OC

InChI

InChI=1S/C14H19N3O4/c1-20-11-6-9-10(7-12(11)21-2)17(8-14(18)19)13(16-9)4-3-5-15/h6-7H,3-5,8,15H2,1-2H3,(H,18,19)