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3-[3-(3-oxidanidyl-3-oxidanylidene-propyl)imidazol-3-ium-1-yl]propanoate

3-[3-(3-oxidanidyl-3-oxidanylidene-propyl)imidazol-3-ium-1-yl]propanoate

Systemtic Name:3-[3-(3-oxidanidyl-3-oxidanylidene-propyl)imidazol-3-ium-1-yl]propanoate
Openeye Name:3-[3-(3-oxido-3-oxo-propyl)imidazol-3-ium-1-yl]propanoate
CAS Name:3-[3-(3-oxido-3-oxopropyl)-1-imidazol-3-iumyl]propanoate
IUPAC Name:3-[3-(3-oxido-3-oxopropyl)imidazol-3-ium-1-yl]propanoate
Traditional Name:3-[3-(3-keto-3-oxido-propyl)imidazol-3-ium-1-yl]propionate
Formula: C9H11N2O4-
MolecularWeight: 211.19464
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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CN1CCC(=O)[O-])CCC(=O)[O-]


Isomeric SMILES

C1=C[N+](=CN1CCC(=O)[O-])CCC(=O)[O-]


InChI

InChI=1S/C9H12N2O4/c12-8(13)1-3-10-5-6-11(7-10)4-2-9(14)15/h5-7H,1-4H2,(H-,12,13,14,15)/p-1


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