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

Systemtic Name: [4-[4-(4-hydroxyphenyl)-1-oxidanyl-butyl]-2,3-bis(oxidanyl)phenyl]sulfanylphosphonic acid Openeye Name: [2,3-dihydroxy-4-[1-hydroxy-4-(4-hydroxyphenyl)butyl]phenyl]sulfanylphosphonic acid CAS Name: [[2,3-dihydroxy-4-[1-hydroxy-4-(4-hydroxyphenyl)butyl]phenyl]thio]phosphonic acid IUPAC Name: [2,3-dihydroxy-4-[1-hydroxy-4-(4-hydroxyphenyl)butyl]phenyl]sulfanylphosphonic acid Traditional Name: [[2,3-dihydroxy-4-[1-hydroxy-4-(4-hydroxyphenyl)butyl]phenyl]thio]phosphonic acid Formula: C16H19O7PS MolecularWeight: 386.356621

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC(C2=C(C(=C(C=C2)SP(=O)(O)O)O)O)O)O

Isomeric SMILES

C1=CC(=CC=C1CCCC(C2=C(C(=C(C=C2)SP(=O)(O)O)O)O)O)O

InChI

InChI=1S/C16H19O7PS/c17-11-6-4-10(5-7-11)2-1-3-13(18)12-8-9-14(16(20)15(12)19)25-24(21,22)23/h4-9,13,17-20H,1-3H2,(H2,21,22,23)