dihexyl phosphate; [(E)-octadec-9-enyl]azanium

Systemtic Name: dihexyl phosphate; [(E)-octadec-9-enyl]azanium Openeye Name: dihexyl phosphate; [(E)-octadec-9-enyl]ammonium CAS Name: dihexyl phosphate; [(E)-octadec-9-enyl]ammonium IUPAC Name: dihexyl phosphate; [(E)-octadec-9-enyl]azanium Traditional Name: dihexyl phosphate; [(E)-octadec-9-enyl]ammonium Formula: C30H64NO4P MolecularWeight: 533.807221

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC[NH3+].CCCCCCOP(=O)([O-])OCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC[NH3+].CCCCCCOP(=O)([O-])OCCCCCC

InChI

InChI=1S/C18H37N.C12H27O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;1-3-5-7-9-11-15-17(13,14)16-12-10-8-6-4-2/h9-10H,2-8,11-19H2,1H3;3-12H2,1-2H3,(H,13,14)/b10-9+;