dimethylazanium; 3,4,5-tris(oxidanyl)cyclohexene-1-carboxylate

Systemtic Name: dimethylazanium; 3,4,5-tris(oxidanyl)cyclohexene-1-carboxylate Openeye Name: dimethylammonium; 3,4,5-trihydroxycyclohexene-1-carboxylate CAS Name: dimethylammonium; 3,4,5-trihydroxy-1-cyclohexenecarboxylate IUPAC Name: dimethylazanium; 3,4,5-trihydroxycyclohexene-1-carboxylate Traditional Name: dimethylammonium; 3,4,5-trihydroxycyclohexene-1-carboxylate Formula: C9H17NO5 MolecularWeight: 219.23498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]C.C1C(C(C(C=C1C(=O)[O-])O)O)O

Isomeric SMILES

C[NH2+]C.C1C(C(C(C=C1C(=O)[O-])O)O)O

InChI

InChI=1S/C7H10O5.C2H7N/c8-4-1-3(7(11)12)2-5(9)6(4)10;1-3-2/h1,4-6,8-10H,2H2,(H,11,12);3H,1-2H3