(2E,6E)-2-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-6-[(4-nitrophenyl)methylidene]cyclohexan-1-one

Systemtic Name: (2E,6E)-2-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-6-[(4-nitrophenyl)methylidene]cyclohexan-1-one Openeye Name: (2E,6E)-2-[(4-hydroxy-3-methoxy-phenyl)methylene]-6-[(4-nitrophenyl)methylene]cyclohexanone CAS Name: (2E,6E)-2-[(4-hydroxy-3-methoxyphenyl)methylidene]-6-[(4-nitrophenyl)methylidene]-1-cyclohexanone IUPAC Name: (2E,6E)-2-[(4-hydroxy-3-methoxyphenyl)methylidene]-6-[(4-nitrophenyl)methylidene]cyclohexan-1-one Traditional Name: (2E,6E)-2-(4-nitrobenzylidene)-6-vanillylidene-cyclohexanone Formula: C21H19NO5 MolecularWeight: 365.37926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2CCCC(=CC3=CC=C(C=C3)[N+](=O)[O-])C2=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\CCC/C(=C\C3=CC=C(C=C3)[N+](=O)[O-])/C2=O)O

InChI

InChI=1S/C21H19NO5/c1-27-20-13-15(7-10-19(20)23)12-17-4-2-3-16(21(17)24)11-14-5-8-18(9-6-14)22(25)26/h5-13,23H,2-4H2,1H3/b16-11+,17-12+