2-(octadecylcarbamoyl)benzoate; tris(2-hydroxyethyl)azanium

Systemtic Name: 2-(octadecylcarbamoyl)benzoate; tris(2-hydroxyethyl)azanium Openeye Name: 2-(octadecylcarbamoyl)benzoate; tris(2-hydroxyethyl)ammonium CAS Name: 2-[(octadecylamino)-oxomethyl]benzoate; tris(2-hydroxyethyl)ammonium IUPAC Name: 2-(octadecylcarbamoyl)benzoate; tris(2-hydroxyethyl)azanium Traditional Name: 2-(stearylcarbamoyl)benzoate; tris(2-hydroxyethyl)ammonium Formula: C32H58N2O6 MolecularWeight: 566.81272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=CC=C1C(=O)[O-].C(CO)[NH+](CCO)CCO

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=CC=C1C(=O)[O-].C(CO)[NH+](CCO)CCO

InChI

InChI=1S/C26H43NO3.C6H15NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-27-25(28)23-20-17-18-21-24(23)26(29)30;8-4-1-7(2-5-9)3-6-10/h17-18,20-21H,2-16,19,22H2,1H3,(H,27,28)(H,29,30);8-10H,1-6H2