(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate CAS Name: (E)-3-(4-cyanophenyl)-2-propenoic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate Traditional Name: (E)-3-(4-cyanophenyl)acrylic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C19H14BrNO4 MolecularWeight: 400.22276

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)C=CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)/C=C/C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H14BrNO4/c20-16-10-18-17(23-7-8-24-18)9-15(16)12-25-19(22)6-5-13-1-3-14(11-21)4-2-13/h1-6,9-10H,7-8,12H2/b6-5+