(6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl (E)-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: (6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl (E)-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl (E)-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-methoxyphenyl)-2-propenoic acid (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl (E)-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxyphenyl)acrylic acid (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C25H21BrO5 MolecularWeight: 481.33524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)OCC2=C3C(=CC(=C2)Br)COC(O3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)OCC2=C3C(=CC(=C2)Br)COC(O3)C4=CC=CC=C4

InChI

InChI=1S/C25H21BrO5/c1-28-22-10-7-17(8-11-22)9-12-23(27)29-15-19-13-21(26)14-20-16-30-25(31-24(19)20)18-5-3-2-4-6-18/h2-14,25H,15-16H2,1H3/b12-9+