tris(2-hydroxyethyl)azanium; 3,4,5-tris(oxidanyl)cyclohexene-1-carboxylate

Systemtic Name: tris(2-hydroxyethyl)azanium; 3,4,5-tris(oxidanyl)cyclohexene-1-carboxylate Openeye Name: 3,4,5-trihydroxycyclohexene-1-carboxylate; tris(2-hydroxyethyl)ammonium CAS Name: 3,4,5-trihydroxy-1-cyclohexenecarboxylate; tris(2-hydroxyethyl)ammonium IUPAC Name: 3,4,5-trihydroxycyclohexene-1-carboxylate; tris(2-hydroxyethyl)azanium Traditional Name: 3,4,5-trihydroxycyclohexene-1-carboxylate; tris(2-hydroxyethyl)ammonium Formula: C13H25NO8 MolecularWeight: 323.3395

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C=C1C(=O)[O-])O)O)O.C(CO)[NH+](CCO)CCO

Isomeric SMILES

C1C(C(C(C=C1C(=O)[O-])O)O)O.C(CO)[NH+](CCO)CCO

InChI

InChI=1S/C7H10O5.C6H15NO3/c8-4-1-3(7(11)12)2-5(9)6(4)10;8-4-1-7(2-5-9)3-6-10/h1,4-6,8-10H,2H2,(H,11,12);8-10H,1-6H2