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

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one CAS Name: (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-(4-methylsulfonylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3-bromo-4-hydroxy-5-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(=CC(=C1)C=CC(=O)C2=CC=C(C=C2)S(=O)(=O)C)Br)O

Isomeric SMILES

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

InChI

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