methyl 3-bromanyl-4-[(E)-3-phenylprop-2-enoyl]oxy-benzoate

Systemtic Name: methyl 3-bromanyl-4-[(E)-3-phenylprop-2-enoyl]oxy-benzoate Openeye Name: methyl 3-bromo-4-[(E)-3-phenylprop-2-enoyl]oxy-benzoate CAS Name: 3-bromo-4-[(E)-1-oxo-3-phenylprop-2-enoxy]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-[(E)-3-phenylprop-2-enoyl]oxybenzoate Traditional Name: 3-bromo-4-[(E)-3-phenylacryloyl]oxy-benzoic acid methyl ester Formula: C17H13BrO4 MolecularWeight: 361.18672

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OC(=O)C=CC2=CC=CC=C2)Br

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OC(=O)/C=C/C2=CC=CC=C2)Br

InChI

InChI=1S/C17H13BrO4/c1-21-17(20)13-8-9-15(14(18)11-13)22-16(19)10-7-12-5-3-2-4-6-12/h2-11H,1H3/b10-7+