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

Systemtic Name: 3-[1-(3-oxidanidyl-3-oxidanylidene-propyl)benzimidazol-2-yl]propanoate Openeye Name: 3-[1-(3-oxido-3-oxo-propyl)benzimidazol-2-yl]propanoate CAS Name: 3-[1-(3-oxido-3-oxopropyl)-2-benzimidazolyl]propanoate IUPAC Name: 3-[1-(3-oxido-3-oxopropyl)benzimidazol-2-yl]propanoate Traditional Name: 3-[1-(3-keto-3-oxido-propyl)benzimidazol-2-yl]propionate Formula: C13H12N2O4-2 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCC(=O)[O-])CCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCC(=O)[O-])CCC(=O)[O-]

InChI

InChI=1S/C13H14N2O4/c16-12(17)6-5-11-14-9-3-1-2-4-10(9)15(11)8-7-13(18)19/h1-4H,5-8H2,(H,16,17)(H,18,19)/p-2