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

Systemtic Name: [2-[4-(3-hydroxyphenyl)butyl]-3-oxidanyl-phenyl]sulfanylphosphonic acid Openeye Name: [3-hydroxy-2-[4-(3-hydroxyphenyl)butyl]phenyl]sulfanylphosphonic acid CAS Name: [[3-hydroxy-2-[4-(3-hydroxyphenyl)butyl]phenyl]thio]phosphonic acid IUPAC Name: [3-hydroxy-2-[4-(3-hydroxyphenyl)butyl]phenyl]sulfanylphosphonic acid Traditional Name: [[3-hydroxy-2-[4-(3-hydroxyphenyl)butyl]phenyl]thio]phosphonic acid Formula: C16H19O5PS MolecularWeight: 354.357821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)CCCCC2=C(C=CC=C2SP(=O)(O)O)O

Isomeric SMILES

C1=CC(=CC(=C1)O)CCCCC2=C(C=CC=C2SP(=O)(O)O)O

InChI

InChI=1S/C16H19O5PS/c17-13-7-3-6-12(11-13)5-1-2-8-14-15(18)9-4-10-16(14)23-22(19,20)21/h3-4,6-7,9-11,17-18H,1-2,5,8H2,(H2,19,20,21)