[2-methyl-5-[4-(4-methyl-4-phosphonooxy-pentanoyl)phenyl]-5-oxidanylidene-pentan-2-yl] dihydrogen phosphate

Systemtic Name: [2-methyl-5-[4-(4-methyl-4-phosphonooxy-pentanoyl)phenyl]-5-oxidanylidene-pentan-2-yl] dihydrogen phosphate Openeye Name: [1,1-dimethyl-4-[4-(4-methyl-4-phosphonooxy-pentanoyl)phenyl]-4-oxo-butyl] dihydrogen phosphate CAS Name: [2-methyl-5-[4-(4-methyl-1-oxo-4-phosphonooxypentyl)phenyl]-5-oxopentan-2-yl] dihydrogen phosphate IUPAC Name: [2-methyl-5-[4-(4-methyl-4-phosphonooxypentanoyl)phenyl]-5-oxopentan-2-yl] dihydrogen phosphate Traditional Name: [4-keto-1,1-dimethyl-4-[4-(4-methyl-4-phosphonooxy-pentanoyl)phenyl]butyl] dihydrogen phosphate Formula: C18H28O10P2 MolecularWeight: 466.356442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28O10P2/c1-17(2,27-29(21,22)23)11-9-15(19)13-5-7-14(8-6-13)16(20)10-12-18(3,4)28-30(24,25)26/h5-8H,9-12H2,1-4H3,(H2,21,22,23)(H2,24,25,26)