(Z)-2-methyl-1-oxidanyl-3-oxidanylidene-3-(2-pentylphenyl)prop-1-en-1-olate phosphate

Systemtic Name: (Z)-2-methyl-1-oxidanyl-3-oxidanylidene-3-(2-pentylphenyl)prop-1-en-1-olate phosphate Openeye Name: (Z)-1-hydroxy-2-methyl-3-oxo-3-(2-pentylphenyl)prop-1-en-1-olate phosphate CAS Name: (Z)-1-hydroxy-2-methyl-3-oxo-3-(2-pentylphenyl)-1-propen-1-olate phosphate IUPAC Name: (Z)-1-hydroxy-2-methyl-3-oxo-3-(2-pentylphenyl)prop-1-en-1-olate phosphate Traditional Name: (Z)-3-(2-amylphenyl)-1-hydroxy-3-keto-2-methyl-prop-1-en-1-olate phosphate Formula: C15H19O7P-4 MolecularWeight: 342.280921

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC=C1C(=O)C(=C(O)[O-])C.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCCCCC1=CC=CC=C1C(=O)/C(=C(\O)/[O-])/C.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C15H20O3.H3O4P/c1-3-4-5-8-12-9-6-7-10-13(12)14(16)11(2)15(17)18;1-5(2,3)4/h6-7,9-10,17-18H,3-5,8H2,1-2H3;(H3,1,2,3,4)/p-4