phosphoric acid; trimethyl(2-oxidanyloctadecyl)azanium

Systemtic Name: phosphoric acid; trimethyl(2-oxidanyloctadecyl)azanium Openeye Name: 2-hydroxyoctadecyl(trimethyl)ammonium; phosphoric acid CAS Name: 2-hydroxyoctadecyl(trimethyl)ammonium; phosphoric acid IUPAC Name: 2-hydroxyoctadecyl(trimethyl)azanium; phosphoric acid Traditional Name: 2-hydroxyoctadecyl(trimethyl)ammonium; phosphoric acid Formula: C21H55NO13P3+ MolecularWeight: 622.581583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C[N+](C)(C)C)O.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C[N+](C)(C)C)O.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O

InChI

InChI=1S/C21H46NO.3H3O4P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(23)20-22(2,3)4;3*1-5(2,3)4/h21,23H,5-20H2,1-4H3;3*(H3,1,2,3,4)/q+1;;;