2-[[2-[bis(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-4-oxidanyl-butyl]amino]ethanoate hydrate

Systemtic Name: 2-[[2-[bis(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-4-oxidanyl-butyl]amino]ethanoate hydrate Openeye Name: 2-[[2-[bis(2-oxido-2-oxo-ethyl)amino]-4-hydroxy-butyl]amino]acetate hydrate CAS Name: 2-[[2-[bis(2-oxido-2-oxoethyl)amino]-4-hydroxybutyl]amino]acetate hydrate IUPAC Name: 2-[[2-[bis(2-oxido-2-oxoethyl)amino]-4-hydroxybutyl]amino]acetate hydrate Traditional Name: 2-[[2-[bis(2-keto-2-oxido-ethyl)amino]-4-hydroxy-butyl]amino]acetate hydrate Formula: C10H17N2O8-3 MolecularWeight: 293.25058

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Descriptors Computed from Structure

Canonical SMILES:

C(CO)C(CNCC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].O

Isomeric SMILES

C(CO)C(CNCC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].O

InChI

InChI=1S/C10H18N2O7.H2O/c13-2-1-7(3-11-4-8(14)15)12(5-9(16)17)6-10(18)19;/h7,11,13H,1-6H2,(H,14,15)(H,16,17)(H,18,19);1H2/p-3