[1-[1,2-bis(diphenoxyphosphoryl)ethoxy]-2-phosphono-ethyl]phosphonic acid

Systemtic Name: [1-[1,2-bis(diphenoxyphosphoryl)ethoxy]-2-phosphono-ethyl]phosphonic acid Openeye Name: [1-[1,2-bis(diphenoxyphosphoryl)ethoxy]-2-phosphono-ethyl]phosphonic acid CAS Name: [1-[1,2-bis(diphenoxyphosphoryl)ethoxy]-2-phosphonoethyl]phosphonic acid IUPAC Name: [1-[1,2-bis(diphenoxyphosphoryl)ethoxy]-2-phosphonoethyl]phosphonic acid Traditional Name: [1-[1,2-bis(diphenoxyphosphoryl)ethoxy]-2-phosphono-ethyl]phosphonic acid Formula: C28H30O13P4 MolecularWeight: 698.425044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OP(=O)(CC(OC(CP(=O)(O)O)P(=O)(O)O)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)OP(=O)(CC(OC(CP(=O)(O)O)P(=O)(O)O)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C28H30O13P4/c29-42(30,31)21-27(44(33,34)35)37-28(45(36,40-25-17-9-3-10-18-25)41-26-19-11-4-12-20-26)22-43(32,38-23-13-5-1-6-14-23)39-24-15-7-2-8-16-24/h1-20,27-28H,21-22H2,(H2,29,30,31)(H2,33,34,35)