(E)-1-(1,3-benzodioxol-5-yl)-3-(3-bromanyl-4-methoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3-bromanyl-4-methoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3-bromo-4-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3-bromo-4-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3-bromo-4-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3-bromo-4-methoxy-phenyl)prop-2-en-1-one Formula: C17H13BrO4 MolecularWeight: 361.18672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC3=C(C=C2)OCO3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC3=C(C=C2)OCO3)Br

InChI

InChI=1S/C17H13BrO4/c1-20-15-6-3-11(8-13(15)18)2-5-14(19)12-4-7-16-17(9-12)22-10-21-16/h2-9H,10H2,1H3/b5-2+