5-[[2,4-bis(fluoranyl)phenyl]methoxy]hexadecyl propyl hydrogen phosphite; 1-methylpiperidin-1-ium

Systemtic Name: 5-[[2,4-bis(fluoranyl)phenyl]methoxy]hexadecyl propyl hydrogen phosphite; 1-methylpiperidin-1-ium Openeye Name: 5-[(2,4-difluorophenyl)methoxy]hexadecyl propyl hydrogen phosphite; 1-methylpiperidin-1-ium CAS Name: 5-[(2,4-difluorophenyl)methoxy]hexadecyl propyl hydrogen phosphite; 1-methylpiperidin-1-ium IUPAC Name: 5-[(2,4-difluorophenyl)methoxy]hexadecyl propyl hydrogen phosphite; 1-methylpiperidin-1-ium Traditional Name: 5-(2,4-difluorobenzyl)oxyhexadecyl propyl hydrogen phosphite; 1-methylpiperidin-1-ium Formula: C32H59F2NO4P+ MolecularWeight: 590.785727

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CCCCOP(O)OCCC)OCC1=C(C=C(C=C1)F)F.C[NH+]1CCCCC1

Isomeric SMILES

CCCCCCCCCCCC(CCCCOP(O)OCCC)OCC1=C(C=C(C=C1)F)F.C[NH+]1CCCCC1

InChI

InChI=1S/C26H45F2O4P.C6H13N/c1-3-5-6-7-8-9-10-11-12-15-25(16-13-14-20-32-33(29)31-19-4-2)30-22-23-17-18-24(27)21-26(23)28;1-7-5-3-2-4-6-7/h17-18,21,25,29H,3-16,19-20,22H2,1-2H3;2-6H2,1H3/p+1