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

Systemtic Name: (2R)-2-[2-(azaniumylmethyl)-5,6-dimethoxy-benzimidazol-1-yl]butanoate Openeye Name: (2R)-2-[2-(azaniumylmethyl)-5,6-dimethoxy-benzimidazol-1-yl]butanoate CAS Name: (2R)-2-[2-(ammoniomethyl)-5,6-dimethoxy-1-benzimidazolyl]butanoate IUPAC Name: (2R)-2-[2-(azaniumylmethyl)-5,6-dimethoxybenzimidazol-1-yl]butanoate Traditional Name: (2R)-2-[2-(ammoniomethyl)-5,6-dimethoxy-benzimidazol-1-yl]butyrate Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O4/c1-4-9(14(18)19)17-10-6-12(21-3)11(20-2)5-8(10)16-13(17)7-15/h5-6,9H,4,7,15H2,1-3H3,(H,18,19)/t9-/m1/s1