azanium 4,5,6,7,8-pentakis(oxidanyl)-2-oxidanylidene-octanoate hydrate

Systemtic Name: azanium 4,5,6,7,8-pentakis(oxidanyl)-2-oxidanylidene-octanoate hydrate Openeye Name: ammonium 4,5,6,7,8-pentahydroxy-2-oxo-octanoate hydrate CAS Name: ammonium 4,5,6,7,8-pentahydroxy-2-oxooctanoate hydrate IUPAC Name: azanium 4,5,6,7,8-pentahydroxy-2-oxooctanoate hydrate Traditional Name: ammonium 4,5,6,7,8-pentahydroxy-2-keto-caprylate hydrate Formula: C8H19NO9 MolecularWeight: 273.23776

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(C(C(CO)O)O)O)O)C(=O)C(=O)[O-].[NH4+].O

Isomeric SMILES

C(C(C(C(C(CO)O)O)O)O)C(=O)C(=O)[O-].[NH4+].O

InChI

InChI=1S/C8H14O8.H3N.H2O/c9-2-5(12)7(14)6(13)3(10)1-4(11)8(15)16;;/h3,5-7,9-10,12-14H,1-2H2,(H,15,16);1H3;1H2