(E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one Openeye Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one CAS Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-propen-1-one IUPAC Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one Traditional Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one Formula: C18H15BrO5 MolecularWeight: 391.2127

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)Br)C=CC(=O)C2=CC3=C(C=C2)OCCO3)O

Isomeric SMILES

COC1=C(C=C(C(=C1)Br)/C=C/C(=O)C2=CC3=C(C=C2)OCCO3)O

InChI

InChI=1S/C18H15BrO5/c1-22-17-10-13(19)11(8-15(17)21)2-4-14(20)12-3-5-16-18(9-12)24-7-6-23-16/h2-5,8-10,21H,6-7H2,1H3/b4-2+