(E)-1-[2,5-bis(oxidanyl)phenyl]-3-(2-bromanyl-5-methoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[2,5-bis(oxidanyl)phenyl]-3-(2-bromanyl-5-methoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(2-bromo-5-methoxy-phenyl)-1-(2,5-dihydroxyphenyl)prop-2-en-1-one CAS Name: (E)-3-(2-bromo-5-methoxyphenyl)-1-(2,5-dihydroxyphenyl)-2-propen-1-one IUPAC Name: (E)-3-(2-bromo-5-methoxyphenyl)-1-(2,5-dihydroxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-(2-bromo-5-methoxy-phenyl)-1-(2,5-dihydroxyphenyl)prop-2-en-1-one Formula: C16H13BrO4 MolecularWeight: 349.17602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrO4/c1-21-12-4-5-14(17)10(8-12)2-6-15(19)13-9-11(18)3-7-16(13)20/h2-9,18,20H,1H3/b6-2+