[1,1-bis[2-(2-bromoethyl)phenyl]-2-phosphono-ethyl]phosphonic acid

Systemtic Name: [1,1-bis[2-(2-bromoethyl)phenyl]-2-phosphono-ethyl]phosphonic acid Openeye Name: [1,1-bis[2-(2-bromoethyl)phenyl]-2-phosphono-ethyl]phosphonic acid CAS Name: [1,1-bis[2-(2-bromoethyl)phenyl]-2-phosphonoethyl]phosphonic acid IUPAC Name: [1,1-bis[2-(2-bromoethyl)phenyl]-2-phosphonoethyl]phosphonic acid Traditional Name: [1,1-bis[2-(2-bromoethyl)phenyl]-2-phosphono-ethyl]phosphonic acid Formula: C18H22Br2O6P2 MolecularWeight: 556.119202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCBr)C(CP(=O)(O)O)(C2=CC=CC=C2CCBr)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C(=C1)CCBr)C(CP(=O)(O)O)(C2=CC=CC=C2CCBr)P(=O)(O)O

InChI

InChI=1S/C18H22Br2O6P2/c19-11-9-14-5-1-3-7-16(14)18(28(24,25)26,13-27(21,22)23)17-8-4-2-6-15(17)10-12-20/h1-8H,9-13H2,(H2,21,22,23)(H2,24,25,26)