(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(1,3-benzodioxol-5-yl)propanoate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(1,3-benzodioxol-5-yl)propanoate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(1,3-benzodioxol-5-yl)propanoate CAS Name: 3-(1,3-benzodioxol-5-yl)propanoic 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 3-(1,3-benzodioxol-5-yl)propanoate Traditional Name: 3-(1,3-benzodioxol-5-yl)propionic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C19H17BrO6 MolecularWeight: 421.23868

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H17BrO6/c20-14-9-18-17(22-5-6-23-18)8-13(14)10-24-19(21)4-2-12-1-3-15-16(7-12)26-11-25-15/h1,3,7-9H,2,4-6,10-11H2