methylphosphanyl 4-(4-bromophenyl)-2,3-dimethyl-4-oxidanylidene-butanoate

Systemtic Name: methylphosphanyl 4-(4-bromophenyl)-2,3-dimethyl-4-oxidanylidene-butanoate Openeye Name: methylphosphanyl 4-(4-bromophenyl)-2,3-dimethyl-4-oxo-butanoate CAS Name: 4-(4-bromophenyl)-2,3-dimethyl-4-oxobutanoic acid methylphosphino ester IUPAC Name: methylphosphanyl 4-(4-bromophenyl)-2,3-dimethyl-4-oxobutanoate Traditional Name: 4-(4-bromophenyl)-4-keto-2,3-dimethyl-butyric acid methylphosphino ester Formula: C13H16BrO3P MolecularWeight: 331.142101

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)C(=O)OPC)C(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CC(C(C)C(=O)OPC)C(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C13H16BrO3P/c1-8(9(2)13(16)17-18-3)12(15)10-4-6-11(14)7-5-10/h4-9,18H,1-3H3