[2-[4-(4-hydroxyphenyl)-1-oxidanyl-butyl]-3-oxidanyl-phenyl]sulfanylphosphonic acid

Systemtic Name: [2-[4-(4-hydroxyphenyl)-1-oxidanyl-butyl]-3-oxidanyl-phenyl]sulfanylphosphonic acid Openeye Name: [3-hydroxy-2-[1-hydroxy-4-(4-hydroxyphenyl)butyl]phenyl]sulfanylphosphonic acid CAS Name: [[3-hydroxy-2-[1-hydroxy-4-(4-hydroxyphenyl)butyl]phenyl]thio]phosphonic acid IUPAC Name: [3-hydroxy-2-[1-hydroxy-4-(4-hydroxyphenyl)butyl]phenyl]sulfanylphosphonic acid Traditional Name: [[3-hydroxy-2-[1-hydroxy-4-(4-hydroxyphenyl)butyl]phenyl]thio]phosphonic acid Formula: C16H19O6PS MolecularWeight: 370.357221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)SP(=O)(O)O)C(CCCC2=CC=C(C=C2)O)O)O

Isomeric SMILES

C1=CC(=C(C(=C1)SP(=O)(O)O)C(CCCC2=CC=C(C=C2)O)O)O

InChI

InChI=1S/C16H19O6PS/c17-12-9-7-11(8-10-12)3-1-4-13(18)16-14(19)5-2-6-15(16)24-23(20,21)22/h2,5-10,13,17-19H,1,3-4H2,(H2,20,21,22)