ditert-butyl [(4R)-4-[2-(4-octylphenyl)ethyl]-2-(trichloromethyl)-5H-1,3-oxazol-4-yl]methyl phosphate

Systemtic Name: ditert-butyl [(4R)-4-[2-(4-octylphenyl)ethyl]-2-(trichloromethyl)-5H-1,3-oxazol-4-yl]methyl phosphate Openeye Name: ditert-butyl [(4R)-4-[2-(4-octylphenyl)ethyl]-2-(trichloromethyl)-5H-oxazol-4-yl]methyl phosphate CAS Name: phosphoric acid ditert-butyl [(4R)-4-[2-(4-octylphenyl)ethyl]-2-(trichloromethyl)-5H-oxazol-4-yl]methyl ester IUPAC Name: ditert-butyl [(4R)-4-[2-(4-octylphenyl)ethyl]-2-(trichloromethyl)-5H-1,3-oxazol-4-yl]methyl phosphate Traditional Name: phosphoric acid ditert-butyl [(4R)-4-[2-(4-octylphenyl)ethyl]-2-(trichloromethyl)-2-oxazolin-4-yl]methyl ester Formula: C29H47Cl3NO5P MolecularWeight: 627.019941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC2(COC(=N2)C(Cl)(Cl)Cl)COP(=O)(OC(C)(C)C)OC(C)(C)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CC[C@@]2(COC(=N2)C(Cl)(Cl)Cl)COP(=O)(OC(C)(C)C)OC(C)(C)C

InChI

InChI=1S/C29H47Cl3NO5P/c1-8-9-10-11-12-13-14-23-15-17-24(18-16-23)19-20-28(21-35-25(33-28)29(30,31)32)22-36-39(34,37-26(2,3)4)38-27(5,6)7/h15-18H,8-14,19-22H2,1-7H3/t28-/m1/s1