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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC(=C(C=C2N1CC(=O)[O-])OC)OC)[NH3+]

Isomeric SMILES

CC[C@@H](C1=NC2=CC(=C(C=C2N1CC(=O)[O-])OC)OC)[NH3+]

InChI

InChI=1S/C14H19N3O4/c1-4-8(15)14-16-9-5-11(20-2)12(21-3)6-10(9)17(14)7-13(18)19/h5-6,8H,4,7,15H2,1-3H3,(H,18,19)/t8-/m0/s1