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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)CCCC(C2=C(C=CC=C2SP(=O)(O)O)O)O

Isomeric SMILES

C1=CC(=CC(=C1)O)CCCC(C2=C(C=CC=C2SP(=O)(O)O)O)O

InChI

InChI=1S/C16H19O6PS/c17-12-6-1-4-11(10-12)5-2-7-13(18)16-14(19)8-3-9-15(16)24-23(20,21)22/h1,3-4,6,8-10,13,17-19H,2,5,7H2,(H2,20,21,22)