[(2E,6E)-3,7-dimethyl-8-prop-2-ynoxy-octa-2,6-dienyl] phosphono hydrogen phosphate

Systemtic Name: [(2E,6E)-3,7-dimethyl-8-prop-2-ynoxy-octa-2,6-dienyl] phosphono hydrogen phosphate Openeye Name: [(2E,6E)-3,7-dimethyl-8-prop-2-ynoxy-octa-2,6-dienyl] phosphono hydrogen phosphate CAS Name: [(2E,6E)-3,7-dimethyl-8-prop-2-ynoxyocta-2,6-dienyl] phosphono hydrogen phosphate IUPAC Name: [(2E,6E)-3,7-dimethyl-8-prop-2-ynoxyocta-2,6-dienyl] phosphono hydrogen phosphate Traditional Name: [(2E,6E)-3,7-dimethyl-8-propargyloxy-octa-2,6-dienyl] phosphono hydrogen phosphate Formula: C13H22O8P2 MolecularWeight: 368.256502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOP(=O)(O)OP(=O)(O)O)CCC=C(C)COCC#C

Isomeric SMILES

C/C(=C\COP(=O)(O)OP(=O)(O)O)/CC/C=C(\C)/COCC#C

InChI

InChI=1S/C13H22O8P2/c1-4-9-19-11-13(3)7-5-6-12(2)8-10-20-23(17,18)21-22(14,15)16/h1,7-8H,5-6,9-11H2,2-3H3,(H,17,18)(H2,14,15,16)/b12-8+,13-7+