[5-(4-bromanyl-2-chloranyl-phenoxy)-4-ethyl-2-nitro-phenyl]-(2,2-dimethylpropanoyloxymethoxy)-oxidanylidene-phosphanium

Systemtic Name: [5-(4-bromanyl-2-chloranyl-phenoxy)-4-ethyl-2-nitro-phenyl]-(2,2-dimethylpropanoyloxymethoxy)-oxidanylidene-phosphanium Openeye Name: [5-(4-bromo-2-chloro-phenoxy)-4-ethyl-2-nitro-phenyl]-(2,2-dimethylpropanoyloxymethoxy)-oxo-phosphonium CAS Name: [5-(4-bromo-2-chlorophenoxy)-4-ethyl-2-nitrophenyl]-[(2,2-dimethyl-1-oxopropoxy)methoxy]-oxophosphonium IUPAC Name: [5-(4-bromo-2-chlorophenoxy)-4-ethyl-2-nitrophenyl]-(2,2-dimethylpropanoyloxymethoxy)-oxophosphanium Traditional Name: [5-(4-bromo-2-chloro-phenoxy)-4-ethyl-2-nitro-phenyl]-keto-(pivaloyloxymethoxy)phosphonium Formula: C20H21BrClNO7P+ MolecularWeight: 533.714001

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1OC2=C(C=C(C=C2)Br)Cl)[P+](=O)OCOC(=O)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=C(C=C1OC2=C(C=C(C=C2)Br)Cl)[P+](=O)OCOC(=O)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H21BrClNO7P/c1-5-12-8-15(23(25)26)18(31(27)29-11-28-19(24)20(2,3)4)10-17(12)30-16-7-6-13(21)9-14(16)22/h6-10H,5,11H2,1-4H3/q+1