(E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-1-(3-methoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-1-(3-methoxyphenyl)prop-2-en-1-one Openeye Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-1-(3-methoxyphenyl)prop-2-en-1-one CAS Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-1-(3-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-1-(3-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-1-(3-methoxyphenyl)prop-2-en-1-one Formula: C17H13BrO4 MolecularWeight: 361.18672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C=CC2=CC3=C(C(=C2)Br)OCO3

Isomeric SMILES

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

InChI

InChI=1S/C17H13BrO4/c1-20-13-4-2-3-12(9-13)15(19)6-5-11-7-14(18)17-16(8-11)21-10-22-17/h2-9H,10H2,1H3/b6-5+