(2E,5E)-2,5-bis(1,3-benzodioxol-4-ylmethylidene)cyclopentan-1-one

Systemtic Name: (2E,5E)-2,5-bis(1,3-benzodioxol-4-ylmethylidene)cyclopentan-1-one Openeye Name: (2E,5E)-2,5-bis(1,3-benzodioxol-4-ylmethylene)cyclopentanone CAS Name: (2E,5E)-2,5-bis(1,3-benzodioxol-4-ylmethylidene)-1-cyclopentanone IUPAC Name: (2E,5E)-2,5-bis(1,3-benzodioxol-4-ylmethylidene)cyclopentan-1-one Traditional Name: (2E,5E)-2,5-bis(1,3-benzodioxol-4-ylmethylene)cyclopentanone Formula: C21H16O5 MolecularWeight: 348.34874

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=C3C(=CC=C2)OCO3)C(=O)C1=CC4=C5C(=CC=C4)OCO5

Isomeric SMILES

C1/C(=C\C2=C3OCOC3=CC=C2)/C(=O)/C(=C/C4=C5OCOC5=CC=C4)/C1

InChI

InChI=1S/C21H16O5/c22-19-13(9-15-3-1-5-17-20(15)25-11-23-17)7-8-14(19)10-16-4-2-6-18-21(16)26-12-24-18/h1-6,9-10H,7-8,11-12H2/b13-9+,14-10+