azanium hexanoate

Systemtic Name: azanium hexanoate Openeye Name: ammonium hexanoate CAS Name: ammonium hexanoate IUPAC Name: azanium hexanoate Traditional Name: ammonium hexanoate Formula: C6H15NO2 MolecularWeight: 133.1888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)[O-].[NH4+]

Isomeric SMILES

CCCCCC(=O)[O-].[NH4+]

InChI

InChI=1S/C6H12O2.H3N/c1-2-3-4-5-6(7)8;/h2-5H2,1H3,(H,7,8);1H3