(E)-[2-(4-chlorophenyl)-5-diazonio-imidazol-4-ylidene]-pyrrolidin-1-yl-methanolate

Systemtic Name: (E)-[2-(4-chlorophenyl)-5-diazonio-imidazol-4-ylidene]-pyrrolidin-1-yl-methanolate Openeye Name: (E)-[2-(4-chlorophenyl)-5-diazonio-imidazol-4-ylidene]-pyrrolidin-1-yl-methanolate CAS Name: (E)-[2-(4-chlorophenyl)-5-diazonio-4-imidazolylidene]-(1-pyrrolidinyl)methanolate IUPAC Name: (E)-[2-(4-chlorophenyl)-5-diazonioimidazol-4-ylidene]-pyrrolidin-1-ylmethanolate Traditional Name: (E)-[2-(4-chlorophenyl)-5-diazonio-imidazol-4-ylidene]-pyrrolidino-methanolate Formula: C14H12ClN5O MolecularWeight: 301.73098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=C2C(=NC(=N2)C3=CC=C(C=C3)Cl)[N+]#N)[O-]

Isomeric SMILES

C1CCN(C1)/C(=C\2/C(=NC(=N2)C3=CC=C(C=C3)Cl)[N+]#N)/[O-]

InChI

InChI=1S/C14H12ClN5O/c15-10-5-3-9(4-6-10)12-17-11(13(18-12)19-16)14(21)20-7-1-2-8-20/h3-6H,1-2,7-8H2