(6-bromanyl-1,3-benzodioxol-5-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate CAS Name: (E)-3-(4-cyanophenyl)-2-propenoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate Traditional Name: (E)-3-(4-cyanophenyl)acrylic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C18H12BrNO4 MolecularWeight: 386.19618

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)COC(=O)C=CC3=CC=C(C=C3)C#N)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)COC(=O)/C=C/C3=CC=C(C=C3)C#N)Br

InChI

InChI=1S/C18H12BrNO4/c19-15-8-17-16(23-11-24-17)7-14(15)10-22-18(21)6-5-12-1-3-13(9-20)4-2-12/h1-8H,10-11H2/b6-5+