2-[[2,6-bis(oxidanyl)phenyl]methyl-(2-oxidanidyl-2-oxidanylidene-ethyl)azaniumyl]ethanoate

Systemtic Name: 2-[[2,6-bis(oxidanyl)phenyl]methyl-(2-oxidanidyl-2-oxidanylidene-ethyl)azaniumyl]ethanoate Openeye Name: 2-[(2,6-dihydroxyphenyl)methyl-(2-oxido-2-oxo-ethyl)ammonio]acetate CAS Name: 2-[(2,6-dihydroxyphenyl)methyl-(2-oxido-2-oxoethyl)ammonio]acetate IUPAC Name: 2-[(2,6-dihydroxyphenyl)methyl-(2-oxido-2-oxoethyl)azaniumyl]acetate Traditional Name: 2-[(2,6-dihydroxybenzyl)-(2-keto-2-oxido-ethyl)ammonio]acetate Formula: C11H12NO6- MolecularWeight: 254.21608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)O)C[NH+](CC(=O)[O-])CC(=O)[O-])O

Isomeric SMILES

C1=CC(=C(C(=C1)O)C[NH+](CC(=O)[O-])CC(=O)[O-])O

InChI

InChI=1S/C11H13NO6/c13-8-2-1-3-9(14)7(8)4-12(5-10(15)16)6-11(17)18/h1-3,13-14H,4-6H2,(H,15,16)(H,17,18)/p-1