(E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one CAS Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-1-(4-methylsulfonylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-1-(4-mesylphenyl)prop-2-en-1-one Formula: C17H15BrO5S MolecularWeight: 411.267

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)Br)C=CC(=O)C2=CC=C(C=C2)S(=O)(=O)C)O

Isomeric SMILES

COC1=C(C=C(C(=C1)Br)/C=C/C(=O)C2=CC=C(C=C2)S(=O)(=O)C)O

InChI

InChI=1S/C17H15BrO5S/c1-23-17-10-14(18)12(9-16(17)20)5-8-15(19)11-3-6-13(7-4-11)24(2,21)22/h3-10,20H,1-2H3/b8-5+