5-(4-bromophenyl)-2-diazonio-1-(4-nitrophenyl)-3,5-bis(oxidanylidene)pent-1-en-1-olate

Systemtic Name: 5-(4-bromophenyl)-2-diazonio-1-(4-nitrophenyl)-3,5-bis(oxidanylidene)pent-1-en-1-olate Openeye Name: 5-(4-bromophenyl)-2-diazonio-1-(4-nitrophenyl)-3,5-dioxo-pent-1-en-1-olate CAS Name: 5-(4-bromophenyl)-2-diazonio-1-(4-nitrophenyl)-3,5-dioxo-1-penten-1-olate IUPAC Name: 5-(4-bromophenyl)-2-diazonio-1-(4-nitrophenyl)-3,5-dioxopent-1-en-1-olate Traditional Name: 5-(4-bromophenyl)-2-diazonio-3,5-diketo-1-(4-nitrophenyl)pent-1-en-1-olate Formula: C17H10BrN3O5 MolecularWeight: 416.1824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=C(C(=O)CC(=O)C2=CC=C(C=C2)Br)[N+]#N)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=C(C(=O)CC(=O)C2=CC=C(C=C2)Br)[N+]#N)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H10BrN3O5/c18-12-5-1-10(2-6-12)14(22)9-15(23)16(20-19)17(24)11-3-7-13(8-4-11)21(25)26/h1-8H,9H2