(2E,6E)-2,6-bis(1,3-benzodioxol-5-ylmethylidene)cyclohexan-1-one

Systemtic Name: (2E,6E)-2,6-bis(1,3-benzodioxol-5-ylmethylidene)cyclohexan-1-one Openeye Name: (2E,6E)-2,6-bis(1,3-benzodioxol-5-ylmethylene)cyclohexanone CAS Name: (2E,6E)-2,6-bis(1,3-benzodioxol-5-ylmethylidene)-1-cyclohexanone IUPAC Name: (2E,6E)-2,6-bis(1,3-benzodioxol-5-ylmethylidene)cyclohexan-1-one Traditional Name: (2E,6E)-2,6-dipiperonylidenecyclohexanone Formula: C22H18O5 MolecularWeight: 362.37532

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC3=C(C=C2)OCO3)C(=O)C(=CC4=CC5=C(C=C4)OCO5)C1

Isomeric SMILES

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

InChI

InChI=1S/C22H18O5/c23-22-16(8-14-4-6-18-20(10-14)26-12-24-18)2-1-3-17(22)9-15-5-7-19-21(11-15)27-13-25-19/h4-11H,1-3,12-13H2/b16-8+,17-9+