dihydrogen phosphate; 2-hydroxyethyl-(2-methyl-3-oxidanyl-hexan-2-yl)azanium; octadecanamide

Systemtic Name: dihydrogen phosphate; 2-hydroxyethyl-(2-methyl-3-oxidanyl-hexan-2-yl)azanium; octadecanamide Openeye Name: dihydrogen phosphate; (2-hydroxy-1,1-dimethyl-pentyl)-(2-hydroxyethyl)ammonium; octadecanamide CAS Name: dihydrogen phosphate; 2-hydroxyethyl-(3-hydroxy-2-methylhexan-2-yl)ammonium; octadecanamide IUPAC Name: dihydrogen phosphate; 2-hydroxyethyl-(3-hydroxy-2-methylhexan-2-yl)azanium; octadecanamide Traditional Name: dihydrogen phosphate; (2-hydroxy-1,1-dimethyl-pentyl)-(2-hydroxyethyl)ammonium; stearamide Formula: C27H61N2O7P MolecularWeight: 556.756201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)N.CCCC(C(C)(C)[NH2+]CCO)O.OP(=O)(O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N.CCCC(C(C)(C)[NH2+]CCO)O.OP(=O)(O)[O-]

InChI

InChI=1S/C18H37NO.C9H21NO2.H3O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-4-5-8(12)9(2,3)10-6-7-11;1-5(2,3)4/h2-17H2,1H3,(H2,19,20);8,10-12H,4-7H2,1-3H3;(H3,1,2,3,4)