3-[3-(3-oxidanidyl-3-oxidanylidene-propyl)-2H-benzimidazol-1-yl]propanoate

Systemtic Name: 3-[3-(3-oxidanidyl-3-oxidanylidene-propyl)-2H-benzimidazol-1-yl]propanoate Openeye Name: 3-[3-(3-oxido-3-oxo-propyl)-2H-benzimidazol-1-yl]propanoate CAS Name: 3-[3-(3-oxido-3-oxopropyl)-2H-benzimidazol-1-yl]propanoate IUPAC Name: 3-[3-(3-oxido-3-oxopropyl)-2H-benzimidazol-1-yl]propanoate Traditional Name: 3-[3-(3-keto-3-oxido-propyl)-2H-benzimidazol-1-yl]propionate Formula: C13H14N2O4-2 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C2=CC=CC=C2N1CCC(=O)[O-])CCC(=O)[O-]

Isomeric SMILES

C1N(C2=CC=CC=C2N1CCC(=O)[O-])CCC(=O)[O-]

InChI

InChI=1S/C13H16N2O4/c16-12(17)5-7-14-9-15(8-6-13(18)19)11-4-2-1-3-10(11)14/h1-4H,5-9H2,(H,16,17)(H,18,19)/p-2