2,2-bis(diphenoxyphosphoryloxymethyl)butyl diphenyl phosphate

Systemtic Name: 2,2-bis(diphenoxyphosphoryloxymethyl)butyl diphenyl phosphate Openeye Name: 2,2-bis(diphenoxyphosphoryloxymethyl)butyl diphenyl phosphate CAS Name: phosphoric acid 2,2-bis(diphenoxyphosphoryloxymethyl)butyl diphenyl ester IUPAC Name: 2,2-bis(diphenoxyphosphoryloxymethyl)butyl diphenyl phosphate Traditional Name: phosphoric acid 2,2-bis(diphenoxyphosphoryloxymethyl)butyl diphenyl ester Formula: C42H41O12P3 MolecularWeight: 830.689023

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2)(COP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)COP(=O)(OC5=CC=CC=C5)OC6=CC=CC=C6

Isomeric SMILES

CCC(COP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2)(COP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)COP(=O)(OC5=CC=CC=C5)OC6=CC=CC=C6

InChI

InChI=1S/C42H41O12P3/c1-2-42(33-46-55(43,49-36-21-9-3-10-22-36)50-37-23-11-4-12-24-37,34-47-56(44,51-38-25-13-5-14-26-38)52-39-27-15-6-16-28-39)35-48-57(45,53-40-29-17-7-18-30-40)54-41-31-19-8-20-32-41/h3-32H,2,33-35H2,1H3