(E)-3-(5-bromanyl-3-methoxy-2-propoxy-phenyl)prop-2-enoate

Systemtic Name: (E)-3-(5-bromanyl-3-methoxy-2-propoxy-phenyl)prop-2-enoate Openeye Name: (E)-3-(5-bromo-3-methoxy-2-propoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-3-methoxy-2-propoxyphenyl)-2-propenoate IUPAC Name: (E)-3-(5-bromo-3-methoxy-2-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-3-methoxy-2-propoxy-phenyl)acrylate Formula: C13H14BrO4- MolecularWeight: 314.15186

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1C=CC(=O)[O-])Br)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1/C=C/C(=O)[O-])Br)OC

InChI

InChI=1S/C13H15BrO4/c1-3-6-18-13-9(4-5-12(15)16)7-10(14)8-11(13)17-2/h4-5,7-8H,3,6H2,1-2H3,(H,15,16)/p-1/b5-4+