dodecyl(dimethyl)azanium; 2-(phosphonatomethylamino)ethanoate

Systemtic Name: dodecyl(dimethyl)azanium; 2-(phosphonatomethylamino)ethanoate Openeye Name: dodecyl(dimethyl)ammonium; 2-(phosphonatomethylamino)acetate CAS Name: dodecyl(dimethyl)ammonium; 2-(phosphonatomethylamino)acetate IUPAC Name: dodecyl(dimethyl)azanium; 2-(phosphonatomethylamino)acetate Traditional Name: lauryl(dimethyl)ammonium; 2-(phosphonatomethylamino)acetate Formula: C45H101N4O5P MolecularWeight: 809.281001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[NH+](C)C.CCCCCCCCCCCC[NH+](C)C.CCCCCCCCCCCC[NH+](C)C.C(C(=O)[O-])NCP(=O)([O-])[O-]

Isomeric SMILES

CCCCCCCCCCCC[NH+](C)C.CCCCCCCCCCCC[NH+](C)C.CCCCCCCCCCCC[NH+](C)C.C(C(=O)[O-])NCP(=O)([O-])[O-]

InChI

InChI=1S/3C14H31N.C3H8NO5P/c3*1-4-5-6-7-8-9-10-11-12-13-14-15(2)3;5-3(6)1-4-2-10(7,8)9/h3*4-14H2,1-3H3;4H,1-2H2,(H,5,6)(H2,7,8,9)