1-[(E)-3-bromanyl-4-oxidanylidene-pent-2-en-2-yl]oxy-1$l^{3},2-benziodoxol-3-one

Systemtic Name: 1-[(E)-3-bromanyl-4-oxidanylidene-pent-2-en-2-yl]oxy-1$l^{3},2-benziodoxol-3-one Openeye Name: 1-[(E)-2-bromo-1-methyl-3-oxo-but-1-enoxy]-1$l^{3},2-benziodoxol-3-one CAS Name: 1-[(E)-3-bromo-4-oxopent-2-en-2-yl]oxy-1$l^{3},2-benziodoxol-3-one IUPAC Name: 1-[(E)-3-bromo-4-oxopent-2-en-2-yl]oxy-1$l^{3},2-benziodoxol-3-one Traditional Name: 1-[(E)-2-bromo-3-keto-1-methyl-but-1-enoxy]-1$l^{3},2-benziodoxol-3-one Formula: C12H10BrIO4 MolecularWeight: 425.01387

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)C)Br)OI1C2=CC=CC=C2C(=O)O1

Isomeric SMILES

C/C(=C(/C(=O)C)\Br)/OI1C2=CC=CC=C2C(=O)O1

InChI

InChI=1S/C12H10BrIO4/c1-7(15)11(13)8(2)17-14-10-6-4-3-5-9(10)12(16)18-14/h3-6H,1-2H3/b11-8+