(3Z,5E)-3,5-bis[(4-azidophenyl)methylidene]-4-oxidanylidene-cyclohexane-1-carboxylic acid

Systemtic Name: (3Z,5E)-3,5-bis[(4-azidophenyl)methylidene]-4-oxidanylidene-cyclohexane-1-carboxylic acid Openeye Name: (3Z,5E)-3,5-bis[(4-azidophenyl)methylene]-4-oxo-cyclohexanecarboxylic acid CAS Name: (3Z,5E)-3,5-bis[(4-azidophenyl)methylidene]-4-oxo-1-cyclohexanecarboxylic acid IUPAC Name: (3Z,5E)-3,5-bis[(4-azidophenyl)methylidene]-4-oxocyclohexane-1-carboxylic acid Traditional Name: (3Z,5E)-3,5-bis(4-azidobenzylidene)-4-keto-cyclohexanecarboxylic acid Formula: C21H16N6O3 MolecularWeight: 400.39014

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=CC2=CC=C(C=C2)N=[N+]=[N-])C(=O)C1=CC3=CC=C(C=C3)N=[N+]=[N-])C(=O)O

Isomeric SMILES

C\1C(C/C(=C/C2=CC=C(C=C2)N=[N+]=[N-])/C(=O)/C1=C/C3=CC=C(C=C3)N=[N+]=[N-])C(=O)O

InChI

InChI=1S/C21H16N6O3/c22-26-24-18-5-1-13(2-6-18)9-15-11-17(21(29)30)12-16(20(15)28)10-14-3-7-19(8-4-14)25-27-23/h1-10,17H,11-12H2,(H,29,30)/b15-9-,16-10+