3-bis(oxidanyl)phosphinothioyloxy-2-[(9E,11E,13E)-octadeca-9,11,13-trienoxy]propan-1-ol

Systemtic Name: 3-bis(oxidanyl)phosphinothioyloxy-2-[(9E,11E,13E)-octadeca-9,11,13-trienoxy]propan-1-ol Openeye Name: 3-dihydroxyphosphinothioyloxy-2-[(9E,11E,13E)-octadeca-9,11,13-trienoxy]propan-1-ol CAS Name: 3-dihydroxyphosphinothioyloxy-2-[(9E,11E,13E)-octadeca-9,11,13-trienoxy]-1-propanol IUPAC Name: 3-dihydroxyphosphinothioyloxy-2-[(9E,11E,13E)-octadeca-9,11,13-trienoxy]propan-1-ol Traditional Name: 3-dihydroxythiophosphoryloxy-2-[(9E,11E,13E)-octadeca-9,11,13-trienoxy]propan-1-ol Formula: C21H39O5PS MolecularWeight: 434.570121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC=CC=CCCCCCCCCOC(CO)COP(=S)(O)O

Isomeric SMILES

CCCC/C=C/C=C/C=C/CCCCCCCCOC(CO)COP(=S)(O)O

InChI

InChI=1S/C21H39O5PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-21(19-22)20-26-27(23,24)28/h5-10,21-22H,2-4,11-20H2,1H3,(H2,23,24,28)/b6-5+,8-7+,10-9+