(2E,6E)-2-(1,3-benzodioxol-5-ylmethylidene)-6-[(4-nitrophenyl)methylidene]cyclohexan-1-one

Systemtic Name: (2E,6E)-2-(1,3-benzodioxol-5-ylmethylidene)-6-[(4-nitrophenyl)methylidene]cyclohexan-1-one Openeye Name: (2E,6E)-2-(1,3-benzodioxol-5-ylmethylene)-6-[(4-nitrophenyl)methylene]cyclohexanone CAS Name: (2E,6E)-2-(1,3-benzodioxol-5-ylmethylidene)-6-[(4-nitrophenyl)methylidene]-1-cyclohexanone IUPAC Name: (2E,6E)-2-(1,3-benzodioxol-5-ylmethylidene)-6-[(4-nitrophenyl)methylidene]cyclohexan-1-one Traditional Name: (2E,6E)-2-(4-nitrobenzylidene)-6-piperonylidene-cyclohexanone Formula: C21H17NO5 MolecularWeight: 363.36338

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C(=CC3=CC4=C(C=C3)OCO4)C1

Isomeric SMILES

C1C/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/C1

InChI

InChI=1S/C21H17NO5/c23-21-16(10-14-4-7-18(8-5-14)22(24)25)2-1-3-17(21)11-15-6-9-19-20(12-15)27-13-26-19/h4-12H,1-3,13H2/b16-10+,17-11+