2-azanylcyclohexane-1,3-diol; ethanoic acid

Systemtic Name: 2-azanylcyclohexane-1,3-diol; ethanoic acid Openeye Name: acetic acid; 2-aminocyclohexane-1,3-diol CAS Name: acetic acid; 2-aminocyclohexane-1,3-diol IUPAC Name: acetic acid; 2-aminocyclohexane-1,3-diol Traditional Name: acetic acid; 2-aminocyclohexane-1,3-diol Formula: C8H17NO4 MolecularWeight: 191.22488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1CC(C(C(C1)O)N)O

Isomeric SMILES

CC(=O)O.C1CC(C(C(C1)O)N)O

InChI

InChI=1S/C6H13NO2.C2H4O2/c7-6-4(8)2-1-3-5(6)9;1-2(3)4/h4-6,8-9H,1-3,7H2;1H3,(H,3,4)