diazanium 2-butyloctanedioate

Systemtic Name: diazanium 2-butyloctanedioate Openeye Name: diammonium 2-butyloctanedioate CAS Name: diammonium 2-butyloctanedioate IUPAC Name: diazanium 2-butyloctanedioate Traditional Name: diammonium 2-butylsuberate Formula: C12H28N2O4 MolecularWeight: 264.36172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O4.2H3N/c1-2-3-7-10(12(15)16)8-5-4-6-9-11(13)14;;/h10H,2-9H2,1H3,(H,13,14)(H,15,16);2*1H3