(3,5-ditert-butylphenyl)methyl-(3-oxidanylpropyl)azanium hexafluorophosphate

Systemtic Name: (3,5-ditert-butylphenyl)methyl-(3-oxidanylpropyl)azanium hexafluorophosphate Openeye Name: (3,5-ditert-butylphenyl)methyl-(3-hydroxypropyl)ammonium hexafluorophosphate CAS Name: (3,5-ditert-butylphenyl)methyl-(3-hydroxypropyl)ammonium hexafluorophosphate IUPAC Name: (3,5-ditert-butylphenyl)methyl-(3-hydroxypropyl)azanium hexafluorophosphate Traditional Name: (3,5-ditert-butylbenzyl)-(3-hydroxypropyl)ammonium hexafluorophosphate Formula: C18H32F6NOP MolecularWeight: 423.41696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C[NH2+]CCCO)C(C)(C)C.F[P-](F)(F)(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C[NH2+]CCCO)C(C)(C)C.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C18H31NO.F6P/c1-17(2,3)15-10-14(13-19-8-7-9-20)11-16(12-15)18(4,5)6;1-7(2,3,4,5)6/h10-12,19-20H,7-9,13H2,1-6H3;/q;-1/p+1