[1,3-bis(2,4-dichlorophenyl)-2-phosphono-propan-2-yl]phosphonic acid

Systemtic Name: [1,3-bis(2,4-dichlorophenyl)-2-phosphono-propan-2-yl]phosphonic acid Openeye Name: [2-(2,4-dichlorophenyl)-1-[(2,4-dichlorophenyl)methyl]-1-phosphono-ethyl]phosphonic acid CAS Name: [1,3-bis(2,4-dichlorophenyl)-2-phosphonopropan-2-yl]phosphonic acid IUPAC Name: [1,3-bis(2,4-dichlorophenyl)-2-phosphonopropan-2-yl]phosphonic acid Traditional Name: [1-(2,4-dichlorobenzyl)-2-(2,4-dichlorophenyl)-1-phosphono-ethyl]phosphonic acid Formula: C15H14Cl4O6P2 MolecularWeight: 494.027582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)CC(CC2=C(C=C(C=C2)Cl)Cl)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)CC(CC2=C(C=C(C=C2)Cl)Cl)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C15H14Cl4O6P2/c16-11-3-1-9(13(18)5-11)7-15(26(20,21)22,27(23,24)25)8-10-2-4-12(17)6-14(10)19/h1-6H,7-8H2,(H2,20,21,22)(H2,23,24,25)