(Z)-[5-diazonio-2-(2,4-dichlorophenyl)imidazol-4-ylidene]-pyrrolidin-1-yl-methanolate

Systemtic Name: (Z)-[5-diazonio-2-(2,4-dichlorophenyl)imidazol-4-ylidene]-pyrrolidin-1-yl-methanolate Openeye Name: (Z)-[5-diazonio-2-(2,4-dichlorophenyl)imidazol-4-ylidene]-pyrrolidin-1-yl-methanolate CAS Name: (Z)-[5-diazonio-2-(2,4-dichlorophenyl)-4-imidazolylidene]-(1-pyrrolidinyl)methanolate IUPAC Name: (Z)-[5-diazonio-2-(2,4-dichlorophenyl)imidazol-4-ylidene]-pyrrolidin-1-ylmethanolate Traditional Name: (Z)-[5-diazonio-2-(2,4-dichlorophenyl)imidazol-4-ylidene]-pyrrolidino-methanolate Formula: C14H11Cl2N5O MolecularWeight: 336.17604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11Cl2N5O/c15-8-3-4-9(10(16)7-8)12-18-11(13(19-12)20-17)14(22)21-5-1-2-6-21/h3-4,7H,1-2,5-6H2