[3,5-dimethyl-4-[(4-oxidanyl-3-propan-2-yl-phenyl)methyl]phenyl]sulfonylmethylphosphonic acid

Systemtic Name: [3,5-dimethyl-4-[(4-oxidanyl-3-propan-2-yl-phenyl)methyl]phenyl]sulfonylmethylphosphonic acid Openeye Name: [4-[(4-hydroxy-3-isopropyl-phenyl)methyl]-3,5-dimethyl-phenyl]sulfonylmethylphosphonic acid CAS Name: [4-[(4-hydroxy-3-propan-2-ylphenyl)methyl]-3,5-dimethylphenyl]sulfonylmethylphosphonic acid IUPAC Name: [4-[(4-hydroxy-3-propan-2-ylphenyl)methyl]-3,5-dimethylphenyl]sulfonylmethylphosphonic acid Traditional Name: [4-(4-hydroxy-3-isopropyl-benzyl)-3,5-dimethyl-phenyl]sulfonylmethylphosphonic acid Formula: C19H25O6PS MolecularWeight: 412.436961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC2=CC(=C(C=C2)O)C(C)C)C)S(=O)(=O)CP(=O)(O)O

Isomeric SMILES

CC1=CC(=CC(=C1CC2=CC(=C(C=C2)O)C(C)C)C)S(=O)(=O)CP(=O)(O)O

InChI

InChI=1S/C19H25O6PS/c1-12(2)17-9-15(5-6-19(17)20)10-18-13(3)7-16(8-14(18)4)27(24,25)11-26(21,22)23/h5-9,12,20H,10-11H2,1-4H3,(H2,21,22,23)