(2R)-2-[2-(azaniumylmethyl)-5,6-dimethoxy-benzimidazol-1-yl]propanoate

Systemtic Name: (2R)-2-[2-(azaniumylmethyl)-5,6-dimethoxy-benzimidazol-1-yl]propanoate Openeye Name: (2R)-2-[2-(azaniumylmethyl)-5,6-dimethoxy-benzimidazol-1-yl]propanoate CAS Name: (2R)-2-[2-(ammoniomethyl)-5,6-dimethoxy-1-benzimidazolyl]propanoate IUPAC Name: (2R)-2-[2-(azaniumylmethyl)-5,6-dimethoxybenzimidazol-1-yl]propanoate Traditional Name: (2R)-2-[2-(ammoniomethyl)-5,6-dimethoxy-benzimidazol-1-yl]propionate Formula: C13H17N3O4 MolecularWeight: 279.29178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N1C2=CC(=C(C=C2N=C1C[NH3+])OC)OC

Isomeric SMILES

C[C@H](C(=O)[O-])N1C2=CC(=C(C=C2N=C1C[NH3+])OC)OC

InChI

InChI=1S/C13H17N3O4/c1-7(13(17)18)16-9-5-11(20-3)10(19-2)4-8(9)15-12(16)6-14/h4-5,7H,6,14H2,1-3H3,(H,17,18)/t7-/m1/s1