(2E,6E)-2,6-bis[(5-nitro-2-oxidanyl-phenyl)methylidene]cyclohexan-1-one

Systemtic Name: (2E,6E)-2,6-bis[(5-nitro-2-oxidanyl-phenyl)methylidene]cyclohexan-1-one Openeye Name: (2E,6E)-2,6-bis[(2-hydroxy-5-nitro-phenyl)methylene]cyclohexanone CAS Name: (2E,6E)-2,6-bis[(2-hydroxy-5-nitrophenyl)methylidene]-1-cyclohexanone IUPAC Name: (2E,6E)-2,6-bis[(2-hydroxy-5-nitrophenyl)methylidene]cyclohexan-1-one Traditional Name: (2E,6E)-2,6-bis(2-hydroxy-5-nitro-benzylidene)cyclohexanone Formula: C20H16N2O7 MolecularWeight: 396.35024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16N2O7/c23-18-6-4-16(21(26)27)10-14(18)8-12-2-1-3-13(20(12)25)9-15-11-17(22(28)29)5-7-19(15)24/h4-11,23-24H,1-3H2/b12-8+,13-9+