[3-tert-butyl-5-[[3-tert-butyl-2-oxidanyl-5-(phosphonomethyl)phenyl]methyl]-4-oxidanyl-phenyl]methylphosphonic acid

Systemtic Name: [3-tert-butyl-5-[[3-tert-butyl-2-oxidanyl-5-(phosphonomethyl)phenyl]methyl]-4-oxidanyl-phenyl]methylphosphonic acid Openeye Name: [3-tert-butyl-5-[[3-tert-butyl-2-hydroxy-5-(phosphonomethyl)phenyl]methyl]-4-hydroxy-phenyl]methylphosphonic acid CAS Name: [3-tert-butyl-5-[[3-tert-butyl-2-hydroxy-5-(phosphonomethyl)phenyl]methyl]-4-hydroxyphenyl]methylphosphonic acid IUPAC Name: [3-tert-butyl-5-[[3-tert-butyl-2-hydroxy-5-(phosphonomethyl)phenyl]methyl]-4-hydroxyphenyl]methylphosphonic acid Traditional Name: [3-tert-butyl-5-[3-tert-butyl-2-hydroxy-5-(phosphonomethyl)benzyl]-4-hydroxy-benzyl]phosphonic acid Formula: C23H34O8P2 MolecularWeight: 500.458782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)CC2=C(C(=CC(=C2)CP(=O)(O)O)C(C)(C)C)O)CP(=O)(O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)CC2=C(C(=CC(=C2)CP(=O)(O)O)C(C)(C)C)O)CP(=O)(O)O

InChI

InChI=1S/C23H34O8P2/c1-22(2,3)18-9-14(12-32(26,27)28)7-16(20(18)24)11-17-8-15(13-33(29,30)31)10-19(21(17)25)23(4,5)6/h7-10,24-25H,11-13H2,1-6H3,(H2,26,27,28)(H2,29,30,31)