[2-methyl-1,3-bis(oxidanyl)propan-2-yl]azanium; (4-methyl-2-oxidanylidene-chromen-7-yl) phosphate

Systemtic Name: [2-methyl-1,3-bis(oxidanyl)propan-2-yl]azanium; (4-methyl-2-oxidanylidene-chromen-7-yl) phosphate Openeye Name: [2-hydroxy-1-(hydroxymethyl)-1-methyl-ethyl]ammonium; (4-methyl-2-oxo-chromen-7-yl) phosphate CAS Name: (1,3-dihydroxy-2-methylpropan-2-yl)ammonium; (4-methyl-2-oxo-1-benzopyran-7-yl) phosphate IUPAC Name: (1,3-dihydroxy-2-methylpropan-2-yl)azanium; (4-methyl-2-oxochromen-7-yl) phosphate Traditional Name: (2-hydroxy-1-methyl-1-methylol-ethyl)ammonium; (2-keto-4-methyl-chromen-7-yl) phosphate Formula: C14H19NO8P- MolecularWeight: 360.276321

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OP(=O)([O-])[O-].CC(CO)(CO)[NH3+]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OP(=O)([O-])[O-].CC(CO)(CO)[NH3+]

InChI

InChI=1S/C10H9O6P.C4H11NO2/c1-6-4-10(11)15-9-5-7(2-3-8(6)9)16-17(12,13)14;1-4(5,2-6)3-7/h2-5H,1H3,(H2,12,13,14);6-7H,2-3,5H2,1H3/p-1