(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-(4-cyanophenoxy)ethanoate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-(4-cyanophenoxy)ethanoate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-(4-cyanophenoxy)acetate CAS Name: 2-(4-cyanophenoxy)acetic 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 2-(4-cyanophenoxy)acetate Traditional Name: 2-(4-cyanophenoxy)acetic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C18H14BrNO5 MolecularWeight: 404.21146

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)COC3=CC=C(C=C3)C#N

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)COC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H14BrNO5/c19-15-8-17-16(22-5-6-23-17)7-13(15)10-25-18(21)11-24-14-3-1-12(9-20)2-4-14/h1-4,7-8H,5-6,10-11H2