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

Systemtic Name: 4-[(Z)-[2-[(4-bromophenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]-2-nitro-phenolate Openeye Name: 4-[(Z)-[2-(4-bromoanilino)-4-oxo-thiazol-5-ylidene]methyl]-2-nitro-phenolate CAS Name: 4-[(Z)-[2-(4-bromoanilino)-4-oxo-5-thiazolylidene]methyl]-2-nitrophenolate IUPAC Name: 4-[(Z)-[2-(4-bromoanilino)-4-oxo-1,3-thiazol-5-ylidene]methyl]-2-nitrophenolate Traditional Name: 4-[(Z)-[2-(4-bromoanilino)-4-keto-2-thiazolin-5-ylidene]methyl]-2-nitro-phenolate Formula: C16H9BrN3O4S- MolecularWeight: 419.22936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC(=O)C(=CC3=CC(=C(C=C3)[O-])[N+](=O)[O-])S2)Br

Isomeric SMILES

C1=CC(=CC=C1NC2=NC(=O)/C(=C/C3=CC(=C(C=C3)[O-])[N+](=O)[O-])/S2)Br

InChI

InChI=1S/C16H10BrN3O4S/c17-10-2-4-11(5-3-10)18-16-19-15(22)14(25-16)8-9-1-6-13(21)12(7-9)20(23)24/h1-8,21H,(H,18,19,22)/p-1/b14-8-