[3-methyl-2,4-bis(oxidanyl)pentan-3-yl]-octyl-azanium phosphate

Systemtic Name: [3-methyl-2,4-bis(oxidanyl)pentan-3-yl]-octyl-azanium phosphate Openeye Name: [2-hydroxy-1-(1-hydroxyethyl)-1-methyl-propyl]-octyl-ammonium phosphate CAS Name: (2,4-dihydroxy-3-methylpentan-3-yl)-octylammonium phosphate IUPAC Name: (2,4-dihydroxy-3-methylpentan-3-yl)-octylazanium phosphate Traditional Name: [2-hydroxy-1-(1-hydroxyethyl)-1-methyl-propyl]-octyl-ammonium phosphate Formula: C14H32NO6P-2 MolecularWeight: 341.380741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[NH2+]C(C)(C(C)O)C(C)O.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCCCCCCC[NH2+]C(C)(C(C)O)C(C)O.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C14H31NO2.H3O4P/c1-5-6-7-8-9-10-11-15-14(4,12(2)16)13(3)17;1-5(2,3)4/h12-13,15-17H,5-11H2,1-4H3;(H3,1,2,3,4)/p-2