[4-[2-[2,4-bis(chloranyl)-6-phenylmethoxy-phenyl]ethyl-(2,2-dimethylpropanoyloxymethoxy)phosphoryl]-3-oxidanyl-butanoyl]oxymethyl 2,2-dimethylpropanoate

Systemtic Name: [4-[2-[2,4-bis(chloranyl)-6-phenylmethoxy-phenyl]ethyl-(2,2-dimethylpropanoyloxymethoxy)phosphoryl]-3-oxidanyl-butanoyl]oxymethyl 2,2-dimethylpropanoate Openeye Name: [4-[2-(2-benzyloxy-4,6-dichloro-phenyl)ethyl-(2,2-dimethylpropanoyloxymethoxy)phosphoryl]-3-hydroxy-butanoyl]oxymethyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[2-(2,4-dichloro-6-phenylmethoxyphenyl)ethyl-[(2,2-dimethyl-1-oxopropoxy)methoxy]phosphoryl]-3-hydroxy-1-oxobutoxy]methyl ester IUPAC Name: [4-[2-(2,4-dichloro-6-phenylmethoxyphenyl)ethyl-(2,2-dimethylpropanoyloxymethoxy)phosphoryl]-3-hydroxybutanoyl]oxymethyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[2-(2-benzoxy-4,6-dichloro-phenyl)ethyl-(pivaloyloxymethoxy)phosphoryl]-3-hydroxy-butanoyl]oxymethyl ester Formula: C31H41Cl2O10P MolecularWeight: 675.531001

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCOC(=O)CC(CP(=O)(CCC1=C(C=C(C=C1OCC2=CC=CC=C2)Cl)Cl)OCOC(=O)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C(=O)OCOC(=O)CC(CP(=O)(CCC1=C(C=C(C=C1OCC2=CC=CC=C2)Cl)Cl)OCOC(=O)C(C)(C)C)O

InChI

InChI=1S/C31H41Cl2O10P/c1-30(2,3)28(36)41-19-40-27(35)16-23(34)18-44(38,43-20-42-29(37)31(4,5)6)13-12-24-25(33)14-22(32)15-26(24)39-17-21-10-8-7-9-11-21/h7-11,14-15,23,34H,12-13,16-20H2,1-6H3