(2S,6E)-2-methyl-6-[(4-nitrophenyl)methylidene]cyclohexan-1-one

Systemtic Name: (2S,6E)-2-methyl-6-[(4-nitrophenyl)methylidene]cyclohexan-1-one Openeye Name: (2S,6E)-2-methyl-6-[(4-nitrophenyl)methylene]cyclohexanone CAS Name: (2S,6E)-2-methyl-6-[(4-nitrophenyl)methylidene]-1-cyclohexanone IUPAC Name: (2S,6E)-2-methyl-6-[(4-nitrophenyl)methylidene]cyclohexan-1-one Traditional Name: (2S,6E)-2-methyl-6-(4-nitrobenzylidene)cyclohexanone Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(=CC2=CC=C(C=C2)[N+](=O)[O-])C1=O

Isomeric SMILES

C[C@H]1CCC/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C1=O

InChI

InChI=1S/C14H15NO3/c1-10-3-2-4-12(14(10)16)9-11-5-7-13(8-6-11)15(17)18/h5-10H,2-4H2,1H3/b12-9+/t10-/m0/s1