(3-fluoranyl-4-methoxy-phenyl)methyl (E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)prop-2-enoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl (E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)prop-2-enoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl (E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-propenoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)acrylic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C18H16BrFO5 MolecularWeight: 411.219043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C=CC2=CC(=C(C(=C2)Br)O)OC)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)/C=C/C2=CC(=C(C(=C2)Br)O)OC)F

InChI

InChI=1S/C18H16BrFO5/c1-23-15-5-3-12(8-14(15)20)10-25-17(21)6-4-11-7-13(19)18(22)16(9-11)24-2/h3-9,22H,10H2,1-2H3/b6-4+