hexanedioate; trimethyl(2-oxidanylpropyl)azanium

Systemtic Name: hexanedioate; trimethyl(2-oxidanylpropyl)azanium Openeye Name: hexanedioate; 2-hydroxypropyl(trimethyl)ammonium CAS Name: hexanedioate; 2-hydroxypropyl(trimethyl)ammonium IUPAC Name: hexanedioate; 2-hydroxypropyl(trimethyl)azanium Traditional Name: adipate; 2-hydroxypropyl(trimethyl)ammonium Formula: C18H40N2O6 MolecularWeight: 380.52

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C[N+](C)(C)C)O.CC(C[N+](C)(C)C)O.C(CCC(=O)[O-])CC(=O)[O-]

Isomeric SMILES

CC(C[N+](C)(C)C)O.CC(C[N+](C)(C)C)O.C(CCC(=O)[O-])CC(=O)[O-]

InChI

InChI=1S/2C6H16NO.C6H10O4/c2*1-6(8)5-7(2,3)4;7-5(8)3-1-2-4-6(9)10/h2*6,8H,5H2,1-4H3;1-4H2,(H,7,8)(H,9,10)/q2*+1;/p-2