2-hydroxyethyl(tripropyl)azanium benzoate chloride

Systemtic Name: 2-hydroxyethyl(tripropyl)azanium benzoate chloride Openeye Name: 2-hydroxyethyl(tripropyl)ammonium benzoate chloride CAS Name: 2-hydroxyethyl(tripropyl)ammonium benzoate chloride IUPAC Name: 2-hydroxyethyl(tripropyl)azanium benzoate chloride Traditional Name: 2-hydroxyethyl(tripropyl)ammonium benzoate chloride Formula: C18H31ClNO3- MolecularWeight: 344.89664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](CCC)(CCC)CCO.C1=CC=C(C=C1)C(=O)[O-].[Cl-]

Isomeric SMILES

CCC[N+](CCC)(CCC)CCO.C1=CC=C(C=C1)C(=O)[O-].[Cl-]

InChI

InChI=1S/C11H26NO.C7H6O2.ClH/c1-4-7-12(8-5-2,9-6-3)10-11-13;8-7(9)6-4-2-1-3-5-6;/h13H,4-11H2,1-3H3;1-5H,(H,8,9);1H/q+1;;/p-2