[[3-aminocarbonyl-5-(phenylcarbonyl)-1,2-oxazol-4-yl]diazenyl]-dimethyl-azanium chloride

Systemtic Name: [[3-aminocarbonyl-5-(phenylcarbonyl)-1,2-oxazol-4-yl]diazenyl]-dimethyl-azanium chloride Openeye Name: (5-benzoyl-3-carbamoyl-isoxazol-4-yl)azo-dimethyl-ammonium chloride CAS Name: (5-benzoyl-3-carbamoyl-4-isoxazolyl)azo-dimethylammonium chloride IUPAC Name: [(5-benzoyl-3-carbamoyl-1,2-oxazol-4-yl)diazenyl]-dimethylazanium chloride Traditional Name: (5-benzoyl-3-carbamoyl-isoxazol-4-yl)azo-dimethyl-ammonium chloride Formula: C13H14ClN5O3 MolecularWeight: 323.73496

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)N=NC1=C(ON=C1C(=O)N)C(=O)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

C[NH+](C)N=NC1=C(ON=C1C(=O)N)C(=O)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C13H13N5O3.ClH/c1-18(2)17-15-9-10(13(14)20)16-21-12(9)11(19)8-6-4-3-5-7-8;/h3-7H,1-2H3,(H2,14,20);1H