[2-(diphenoxyphosphorylmethyl)-3-phosphono-2-(phosphonomethyl)propyl]phosphonic acid

Systemtic Name: [2-(diphenoxyphosphorylmethyl)-3-phosphono-2-(phosphonomethyl)propyl]phosphonic acid Openeye Name: [2-(diphenoxyphosphorylmethyl)-3-phosphono-2-(phosphonomethyl)propyl]phosphonic acid CAS Name: [2-(diphenoxyphosphorylmethyl)-3-phosphono-2-(phosphonomethyl)propyl]phosphonic acid IUPAC Name: [2-(diphenoxyphosphorylmethyl)-3-phosphono-2-(phosphonomethyl)propyl]phosphonic acid Traditional Name: [2-(diphenoxyphosphorylmethyl)-3-phosphono-2-(phosphonomethyl)propyl]phosphonic acid Formula: C17H24O12P4 MolecularWeight: 544.260304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OP(=O)(CC(CP(=O)(O)O)(CP(=O)(O)O)CP(=O)(O)O)OC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)OP(=O)(CC(CP(=O)(O)O)(CP(=O)(O)O)CP(=O)(O)O)OC2=CC=CC=C2

InChI

InChI=1S/C17H24O12P4/c18-30(19,20)11-17(12-31(21,22)23,13-32(24,25)26)14-33(27,28-15-7-3-1-4-8-15)29-16-9-5-2-6-10-16/h1-10H,11-14H2,(H2,18,19,20)(H2,21,22,23)(H2,24,25,26)