dihexadecyl(dimethyl)azanium; 2-oxidanylbenzoate

Systemtic Name: dihexadecyl(dimethyl)azanium; 2-oxidanylbenzoate Openeye Name: dihexadecyl(dimethyl)ammonium; 2-hydroxybenzoate CAS Name: dihexadecyl(dimethyl)ammonium; 2-hydroxybenzoate IUPAC Name: dihexadecyl(dimethyl)azanium; 2-hydroxybenzoate Traditional Name: dicetyl(dimethyl)ammonium; salicylate Formula: C41H77NO3 MolecularWeight: 632.05498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCC.C1=CC=C(C(=C1)C(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCC.C1=CC=C(C(=C1)C(=O)[O-])O

InChI

InChI=1S/C34H72N.C7H6O3/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(3,4)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;8-6-4-2-1-3-5(6)7(9)10/h5-34H2,1-4H3;1-4,8H,(H,9,10)/q+1;/p-1