hexadecyl(trimethyl)azanium; [(2R,3S)-3-methyloxiran-2-yl]-oxidanyl-phosphinate

Systemtic Name: hexadecyl(trimethyl)azanium; [(2R,3S)-3-methyloxiran-2-yl]-oxidanyl-phosphinate Openeye Name: hexadecyl(trimethyl)ammonium; hydroxy-[(2R,3S)-3-methyloxiran-2-yl]phosphinate CAS Name: hexadecyl(trimethyl)ammonium; hydroxy-[(2R,3S)-3-methyl-2-oxiranyl]phosphinate IUPAC Name: hexadecyl(trimethyl)azanium; hydroxy-[(2R,3S)-3-methyloxiran-2-yl]phosphinate Traditional Name: cetyl(trimethyl)ammonium; hydroxy-[(2R,3S)-3-methyloxiran-2-yl]phosphinate Formula: C22H48NO4P MolecularWeight: 421.594581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)C.CC1C(O1)P(=O)(O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)C.C[C@H]1[C@H](O1)P(=O)(O)[O-]

InChI

InChI=1S/C19H42N.C3H7O4P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;1-2-3(7-2)8(4,5)6/h5-19H2,1-4H3;2-3H,1H3,(H2,4,5,6)/q+1;/p-1/t;2-,3+/m.0/s1