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

Systemtic Name: dibutyl phosphate; [(E)-octadec-9-enyl]azanium Openeye Name: dibutyl phosphate; [(E)-octadec-9-enyl]ammonium CAS Name: dibutyl phosphate; [(E)-octadec-9-enyl]ammonium IUPAC Name: dibutyl phosphate; [(E)-octadec-9-enyl]azanium Traditional Name: dibutyl phosphate; [(E)-octadec-9-enyl]ammonium Formula: C26H56NO4P MolecularWeight: 477.700901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC[NH3+].CCCCOP(=O)([O-])OCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC[NH3+].CCCCOP(=O)([O-])OCCCC

InChI

InChI=1S/C18H37N.C8H19O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;1-3-5-7-11-13(9,10)12-8-6-4-2/h9-10H,2-8,11-19H2,1H3;3-8H2,1-2H3,(H,9,10)/b10-9+;