[2-[2-(3-hydroxyphenyl)butanoyl]-5-oxidanyl-phenyl]sulfanylphosphonic acid

Systemtic Name: [2-[2-(3-hydroxyphenyl)butanoyl]-5-oxidanyl-phenyl]sulfanylphosphonic acid Openeye Name: [5-hydroxy-2-[2-(3-hydroxyphenyl)butanoyl]phenyl]sulfanylphosphonic acid CAS Name: [[5-hydroxy-2-[2-(3-hydroxyphenyl)-1-oxobutyl]phenyl]thio]phosphonic acid IUPAC Name: [5-hydroxy-2-[2-(3-hydroxyphenyl)butanoyl]phenyl]sulfanylphosphonic acid Traditional Name: [[5-hydroxy-2-[2-(3-hydroxyphenyl)butanoyl]phenyl]thio]phosphonic acid Formula: C16H17O6PS MolecularWeight: 368.341341

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)O)C(=O)C2=C(C=C(C=C2)O)SP(=O)(O)O

Isomeric SMILES

CCC(C1=CC(=CC=C1)O)C(=O)C2=C(C=C(C=C2)O)SP(=O)(O)O

InChI

InChI=1S/C16H17O6PS/c1-2-13(10-4-3-5-11(17)8-10)16(19)14-7-6-12(18)9-15(14)24-23(20,21)22/h3-9,13,17-18H,2H2,1H3,(H2,20,21,22)