bis(2-cyanoethyl) [(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] phosphate

Systemtic Name: bis(2-cyanoethyl) [(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] phosphate Openeye Name: bis(2-cyanoethyl) [(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] phosphate CAS Name: phosphoric acid bis(2-cyanoethyl) [(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] ester IUPAC Name: bis(2-cyanoethyl) [(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] phosphate Traditional Name: phosphoric acid bis(2-cyanoethyl) [(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] ester Formula: C21H33N2O4P MolecularWeight: 408.471481

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCOP(=O)(OCCC#N)OCCC#N)C)C)C

Isomeric SMILES

CC(=CCC/C(=C\CC/C(=C\COP(=O)(OCCC#N)OCCC#N)/C)/C)C

InChI

InChI=1S/C21H33N2O4P/c1-19(2)9-5-10-20(3)11-6-12-21(4)13-18-27-28(24,25-16-7-14-22)26-17-8-15-23/h9,11,13H,5-8,10,12,16-18H2,1-4H3/b20-11-,21-13-