bis(oxidanyl)phosphinothioyl (E)-3-propyloctadec-9-eneperoxoate

Systemtic Name: bis(oxidanyl)phosphinothioyl (E)-3-propyloctadec-9-eneperoxoate Openeye Name: dihydroxyphosphinothioyl (E)-3-propyloctadec-9-eneperoxoate CAS Name: (E)-3-propyl-9-octadeceneperoxoic acid dihydroxyphosphinothioyl ester IUPAC Name: dihydroxyphosphinothioyl (E)-3-propyloctadec-9-eneperoxoate Traditional Name: (E)-3-propyloctadec-9-eneperoxoic acid dihydroxythiophosphoryl ester Formula: C21H41O5PS MolecularWeight: 436.586001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCC(CCC)CC(=O)OOP(=S)(O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCC(CCC)CC(=O)OOP(=S)(O)O

InChI

InChI=1S/C21H41O5PS/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-20(17-4-2)19-21(22)25-26-27(23,24)28/h11-12,20H,3-10,13-19H2,1-2H3,(H2,23,24,28)/b12-11+