tert-butyl 3-(4-bromophenyl)-2-diethoxyphosphoryl-5-oxidanylidene-hexanoate

Systemtic Name: tert-butyl 3-(4-bromophenyl)-2-diethoxyphosphoryl-5-oxidanylidene-hexanoate Openeye Name: tert-butyl 3-(4-bromophenyl)-2-diethoxyphosphoryl-5-oxo-hexanoate CAS Name: 3-(4-bromophenyl)-2-diethoxyphosphoryl-5-oxohexanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-bromophenyl)-2-diethoxyphosphoryl-5-oxohexanoate Traditional Name: 3-(4-bromophenyl)-2-diethoxyphosphoryl-5-keto-hexanoic acid tert-butyl ester Formula: C20H30BrO6P MolecularWeight: 477.326361

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C(CC(=O)C)C1=CC=C(C=C1)Br)C(=O)OC(C)(C)C)OCC

Isomeric SMILES

CCOP(=O)(C(C(CC(=O)C)C1=CC=C(C=C1)Br)C(=O)OC(C)(C)C)OCC

InChI

InChI=1S/C20H30BrO6P/c1-7-25-28(24,26-8-2)18(19(23)27-20(4,5)6)17(13-14(3)22)15-9-11-16(21)12-10-15/h9-12,17-18H,7-8,13H2,1-6H3