2-[(Z)-[2-(4-bromophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-4-nitro-phenolate

Systemtic Name: 2-[(Z)-[2-(4-bromophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-4-nitro-phenolate Openeye Name: 2-[(Z)-[2-(4-bromophenyl)-5-oxo-oxazol-4-ylidene]methyl]-4-nitro-phenolate CAS Name: 2-[(Z)-[2-(4-bromophenyl)-5-oxo-4-oxazolylidene]methyl]-4-nitrophenolate IUPAC Name: 2-[(Z)-[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-4-nitrophenolate Traditional Name: 2-[(Z)-[2-(4-bromophenyl)-5-keto-2-oxazolin-4-ylidene]methyl]-4-nitro-phenolate Formula: C16H8BrN2O5- MolecularWeight: 388.14912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])C(=O)O2)Br

Isomeric SMILES

C1=CC(=CC=C1C2=N/C(=C\C3=C(C=CC(=C3)[N+](=O)[O-])[O-])/C(=O)O2)Br

InChI

InChI=1S/C16H9BrN2O5/c17-11-3-1-9(2-4-11)15-18-13(16(21)24-15)8-10-7-12(19(22)23)5-6-14(10)20/h1-8,20H/p-1/b13-8-