[2-methyl-6-[4-(5-methyl-2-oxidanylidene-hexyl)phenyl]-5-oxidanylidene-hexan-2-yl] dihydrogen phosphate

Systemtic Name: [2-methyl-6-[4-(5-methyl-2-oxidanylidene-hexyl)phenyl]-5-oxidanylidene-hexan-2-yl] dihydrogen phosphate Openeye Name: [1,1-dimethyl-5-[4-(5-methyl-2-oxo-hexyl)phenyl]-4-oxo-pentyl] dihydrogen phosphate CAS Name: [2-methyl-6-[4-(5-methyl-2-oxohexyl)phenyl]-5-oxohexan-2-yl] dihydrogen phosphate IUPAC Name: [2-methyl-6-[4-(5-methyl-2-oxohexyl)phenyl]-5-oxohexan-2-yl] dihydrogen phosphate Traditional Name: [4-keto-5-[4-(2-keto-5-methyl-hexyl)phenyl]-1,1-dimethyl-pentyl] dihydrogen phosphate Formula: C20H31O6P MolecularWeight: 398.430301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)CC1=CC=C(C=C1)CC(=O)CCC(C)(C)OP(=O)(O)O

Isomeric SMILES

CC(C)CCC(=O)CC1=CC=C(C=C1)CC(=O)CCC(C)(C)OP(=O)(O)O

InChI

InChI=1S/C20H31O6P/c1-15(2)5-10-18(21)13-16-6-8-17(9-7-16)14-19(22)11-12-20(3,4)26-27(23,24)25/h6-9,15H,5,10-14H2,1-4H3,(H2,23,24,25)