methanesulfonate; 1-(5-methylfuran-2-yl)-2-oxidanyl-2-phenyl-ethanone

Systemtic Name: methanesulfonate; 1-(5-methylfuran-2-yl)-2-oxidanyl-2-phenyl-ethanone Openeye Name: 2-hydroxy-1-(5-methyl-2-furyl)-2-phenyl-ethanone; methanesulfonate CAS Name: 2-hydroxy-1-(5-methyl-2-furanyl)-2-phenylethanone; methanesulfonate IUPAC Name: 2-hydroxy-1-(5-methylfuran-2-yl)-2-phenylethanone; methanesulfonate Traditional Name: 2-hydroxy-1-(5-methyl-2-furyl)-2-phenyl-ethanone mesylate Formula: C14H15O6S- MolecularWeight: 311.3303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(=O)C(C2=CC=CC=C2)O.CS(=O)(=O)[O-]

Isomeric SMILES

CC1=CC=C(O1)C(=O)C(C2=CC=CC=C2)O.CS(=O)(=O)[O-]

InChI

InChI=1S/C13H12O3.CH4O3S/c1-9-7-8-11(16-9)13(15)12(14)10-5-3-2-4-6-10;1-5(2,3)4/h2-8,12,14H,1H3;1H3,(H,2,3,4)/p-1