[(4-methylphenyl)-oxidanyl-phosphono-methyl]phosphonic acid

Systemtic Name: [(4-methylphenyl)-oxidanyl-phosphono-methyl]phosphonic acid Openeye Name: [hydroxy-phosphono-(p-tolyl)methyl]phosphonic acid CAS Name: [hydroxy-(4-methylphenyl)-phosphonomethyl]phosphonic acid IUPAC Name: [hydroxy-(4-methylphenyl)-phosphonomethyl]phosphonic acid Traditional Name: [hydroxy-phosphono-(p-tolyl)methyl]phosphonic acid Formula: C8H12O7P2 MolecularWeight: 282.124202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C8H12O7P2/c1-6-2-4-7(5-3-6)8(9,16(10,11)12)17(13,14)15/h2-5,9H,1H3,(H2,10,11,12)(H2,13,14,15)