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

Systemtic Name: 3-[2-[(1S)-1-azaniumylpropyl]-5,6-dimethoxy-benzimidazol-1-yl]propanoate Openeye Name: 3-[2-[(1S)-1-azaniumylpropyl]-5,6-dimethoxy-benzimidazol-1-yl]propanoate CAS Name: 3-[2-[(1S)-1-ammoniopropyl]-5,6-dimethoxy-1-benzimidazolyl]propanoate IUPAC Name: 3-[2-[(1S)-1-azaniumylpropyl]-5,6-dimethoxybenzimidazol-1-yl]propanoate Traditional Name: 3-[2-[(1S)-1-ammoniopropyl]-5,6-dimethoxy-benzimidazol-1-yl]propionate Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC(=C(C=C2N1CCC(=O)[O-])OC)OC)[NH3+]

Isomeric SMILES

CC[C@@H](C1=NC2=CC(=C(C=C2N1CCC(=O)[O-])OC)OC)[NH3+]

InChI

InChI=1S/C15H21N3O4/c1-4-9(16)15-17-10-7-12(21-2)13(22-3)8-11(10)18(15)6-5-14(19)20/h7-9H,4-6,16H2,1-3H3,(H,19,20)/t9-/m0/s1