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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1/C(=C/C2=CC(=CC=C2)N=[N+]=[N-])/C(=O)/C(=C\C3=CC(=CC=C3)N=[N+]=[N-])/CC1C(=O)O

InChI

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