(2E,6E)-2,6-bis[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]cyclohexan-1-one

Systemtic Name: (2E,6E)-2,6-bis[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]cyclohexan-1-one Openeye Name: (2E,6E)-2,6-bis[(6-bromo-1,3-benzodioxol-5-yl)methylene]cyclohexanone CAS Name: (2E,6E)-2,6-bis[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1-cyclohexanone IUPAC Name: (2E,6E)-2,6-bis[(6-bromo-1,3-benzodioxol-5-yl)methylidene]cyclohexan-1-one Traditional Name: (2E,6E)-2,6-bis[(6-bromo-1,3-benzodioxol-5-yl)methylene]cyclohexanone Formula: C22H16Br2O5 MolecularWeight: 520.16744

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC3=C(C=C2Br)OCO3)C(=O)C(=CC4=CC5=C(C=C4Br)OCO5)C1

Isomeric SMILES

C1C/C(=C\C2=CC3=C(OCO3)C=C2Br)/C(=O)/C(=C/C4=CC5=C(OCO5)C=C4Br)/C1

InChI

InChI=1S/C22H16Br2O5/c23-16-8-20-18(26-10-28-20)6-14(16)4-12-2-1-3-13(22(12)25)5-15-7-19-21(9-17(15)24)29-11-27-19/h4-9H,1-3,10-11H2/b12-4+,13-5+