5-dodecanoyl-2-oxidanyl-benzoate; 2-hydroxyethyl(dimethyl)azanium

Systemtic Name: 5-dodecanoyl-2-oxidanyl-benzoate; 2-hydroxyethyl(dimethyl)azanium Openeye Name: 5-dodecanoyl-2-hydroxy-benzoate; 2-hydroxyethyl(dimethyl)ammonium CAS Name: 2-hydroxyethyl(dimethyl)ammonium; 2-hydroxy-5-(1-oxododecyl)benzoate IUPAC Name: 5-dodecanoyl-2-hydroxybenzoate; 2-hydroxyethyl(dimethyl)azanium Traditional Name: 2-hydroxyethyl(dimethyl)ammonium; 2-hydroxy-5-lauroyl-benzoate Formula: C23H39NO5 MolecularWeight: 409.55946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=CC(=C(C=C1)O)C(=O)[O-].C[NH+](C)CCO

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=CC(=C(C=C1)O)C(=O)[O-].C[NH+](C)CCO

InChI

InChI=1S/C19H28O4.C4H11NO/c1-2-3-4-5-6-7-8-9-10-11-17(20)15-12-13-18(21)16(14-15)19(22)23;1-5(2)3-4-6/h12-14,21H,2-11H2,1H3,(H,22,23);6H,3-4H2,1-2H3