3-[2-(2-azaniumylethyl)-5,6-dimethoxy-benzimidazol-1-yl]propanoate

Systemtic Name: 3-[2-(2-azaniumylethyl)-5,6-dimethoxy-benzimidazol-1-yl]propanoate Openeye Name: 3-[2-(2-azaniumylethyl)-5,6-dimethoxy-benzimidazol-1-yl]propanoate CAS Name: 3-[2-(2-ammonioethyl)-5,6-dimethoxy-1-benzimidazolyl]propanoate IUPAC Name: 3-[2-(2-azaniumylethyl)-5,6-dimethoxybenzimidazol-1-yl]propanoate Traditional Name: 3-[2-(2-ammonioethyl)-5,6-dimethoxy-benzimidazol-1-yl]propionate Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N2CCC(=O)[O-])CC[NH3+])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N2CCC(=O)[O-])CC[NH3+])OC

InChI

InChI=1S/C14H19N3O4/c1-20-11-7-9-10(8-12(11)21-2)17(6-4-14(18)19)13(16-9)3-5-15/h7-8H,3-6,15H2,1-2H3,(H,18,19)