(3Z,5E)-3,5-bis[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methylidene]-1-methyl-piperidin-4-one

Systemtic Name: (3Z,5E)-3,5-bis[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methylidene]-1-methyl-piperidin-4-one Openeye Name: (3Z,5E)-3,5-bis[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methylene]-1-methyl-piperidin-4-one CAS Name: (3Z,5E)-3,5-bis[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methylidene]-1-methyl-4-piperidinone IUPAC Name: (3Z,5E)-3,5-bis[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methylidene]-1-methylpiperidin-4-one Traditional Name: (3Z,5E)-3,5-bis[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methylene]-1-methyl-4-piperidone Formula: C26H27NO9 MolecularWeight: 497.49388

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=CC2=CC(=C3C(=C2OC)OCO3)OC)C(=O)C(=CC4=CC(=C5C(=C4OC)OCO5)OC)C1

Isomeric SMILES

CN1C/C(=C\C2=CC(=C3C(=C2OC)OCO3)OC)/C(=O)/C(=C\C4=CC(=C5C(=C4OC)OCO5)OC)/C1

InChI

InChI=1S/C26H27NO9/c1-27-10-16(6-14-8-18(29-2)23-25(21(14)31-4)35-12-33-23)20(28)17(11-27)7-15-9-19(30-3)24-26(22(15)32-5)36-13-34-24/h6-9H,10-13H2,1-5H3/b16-6-,17-7+