[2-[3-(3-hydroxyphenyl)butyl]-3,5-bis(oxidanyl)phenyl]sulfanylphosphonic acid

Systemtic Name: [2-[3-(3-hydroxyphenyl)butyl]-3,5-bis(oxidanyl)phenyl]sulfanylphosphonic acid Openeye Name: [3,5-dihydroxy-2-[3-(3-hydroxyphenyl)butyl]phenyl]sulfanylphosphonic acid CAS Name: [[3,5-dihydroxy-2-[3-(3-hydroxyphenyl)butyl]phenyl]thio]phosphonic acid IUPAC Name: [3,5-dihydroxy-2-[3-(3-hydroxyphenyl)butyl]phenyl]sulfanylphosphonic acid Traditional Name: [[3,5-dihydroxy-2-[3-(3-hydroxyphenyl)butyl]phenyl]thio]phosphonic acid Formula: C16H19O6PS MolecularWeight: 370.357221

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=C(C=C(C=C1SP(=O)(O)O)O)O)C2=CC(=CC=C2)O

Isomeric SMILES

CC(CCC1=C(C=C(C=C1SP(=O)(O)O)O)O)C2=CC(=CC=C2)O

InChI

InChI=1S/C16H19O6PS/c1-10(11-3-2-4-12(17)7-11)5-6-14-15(19)8-13(18)9-16(14)24-23(20,21)22/h2-4,7-10,17-19H,5-6H2,1H3,(H2,20,21,22)