4-butyloctylazanium; 2-ethylhexyl hydrogen phosphate

Systemtic Name: 4-butyloctylazanium; 2-ethylhexyl hydrogen phosphate Openeye Name: 4-butyloctylammonium; 2-ethylhexyl hydrogen phosphate CAS Name: 4-butyloctylammonium; 2-ethylhexyl hydrogen phosphate IUPAC Name: 4-butyloctylazanium; 2-ethylhexyl hydrogen phosphate Traditional Name: 4-butyloctylammonium; 2-ethylhexyl hydrogen phosphate Formula: C20H46NO4P MolecularWeight: 395.557301

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COP(=O)(O)[O-].CCCCC(CCCC)CCC[NH3+]

Isomeric SMILES

CCCCC(CC)COP(=O)(O)[O-].CCCCC(CCCC)CCC[NH3+]

InChI

InChI=1S/C12H27N.C8H19O4P/c1-3-5-8-12(9-6-4-2)10-7-11-13;1-3-5-6-8(4-2)7-12-13(9,10)11/h12H,3-11,13H2,1-2H3;8H,3-7H2,1-2H3,(H2,9,10,11)