[[2-bromanyl-4-[[(3,4-dichlorophenyl)-[5-(4-methylsulfonylphenyl)-1,3-oxazol-2-yl]amino]methyl]phenyl]-bis(fluoranyl)methyl]-(2,2-dimethylpropanoyloxymethoxy)phosphinic acid

Systemtic Name: [[2-bromanyl-4-[[(3,4-dichlorophenyl)-[5-(4-methylsulfonylphenyl)-1,3-oxazol-2-yl]amino]methyl]phenyl]-bis(fluoranyl)methyl]-(2,2-dimethylpropanoyloxymethoxy)phosphinic acid Openeye Name: [[2-bromo-4-[(3,4-dichloro-N-[5-(4-methylsulfonylphenyl)oxazol-2-yl]anilino)methyl]phenyl]-difluoro-methyl]-(2,2-dimethylpropanoyloxymethoxy)phosphinic acid CAS Name: [[2-bromo-4-[(3,4-dichloro-N-[5-(4-methylsulfonylphenyl)-2-oxazolyl]anilino)methyl]phenyl]-difluoromethyl]-[(2,2-dimethyl-1-oxopropoxy)methoxy]phosphinic acid IUPAC Name: [[2-bromo-4-[(3,4-dichloro-N-[5-(4-methylsulfonylphenyl)-1,3-oxazol-2-yl]anilino)methyl]phenyl]-difluoromethyl]-(2,2-dimethylpropanoyloxymethoxy)phosphinic acid Traditional Name: [[2-bromo-4-[(3,4-dichloro-N-[5-(4-mesylphenyl)oxazol-2-yl]anilino)methyl]phenyl]-difluoro-methyl]-(pivaloyloxymethoxy)phosphinic acid Formula: C30H28BrCl2F2N2O8PS MolecularWeight: 796.397487

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCOP(=O)(C(C1=C(C=C(C=C1)CN(C2=CC(=C(C=C2)Cl)Cl)C3=NC=C(O3)C4=CC=C(C=C4)S(=O)(=O)C)Br)(F)F)O

Isomeric SMILES

CC(C)(C)C(=O)OCOP(=O)(C(C1=C(C=C(C=C1)CN(C2=CC(=C(C=C2)Cl)Cl)C3=NC=C(O3)C4=CC=C(C=C4)S(=O)(=O)C)Br)(F)F)O

InChI

InChI=1S/C30H28BrCl2F2N2O8PS/c1-29(2,3)27(38)43-17-44-46(39,40)30(34,35)22-11-5-18(13-23(22)31)16-37(20-8-12-24(32)25(33)14-20)28-36-15-26(45-28)19-6-9-21(10-7-19)47(4,41)42/h5-15H,16-17H2,1-4H3,(H,39,40)