(E)-(3-methyl-5-oxidanylidene-1,2-oxazol-4-ylidene)-phenylazanyl-azanium chloride

Systemtic Name: (E)-(3-methyl-5-oxidanylidene-1,2-oxazol-4-ylidene)-phenylazanyl-azanium chloride Openeye Name: (E)-anilino-(3-methyl-5-oxo-isoxazol-4-ylidene)ammonium chloride CAS Name: (E)-anilino-(3-methyl-5-oxo-4-isoxazolylidene)ammonium chloride IUPAC Name: (E)-anilino-(3-methyl-5-oxo-1,2-oxazol-4-ylidene)azanium chloride Traditional Name: (E)-anilino-(5-keto-3-methyl-2-isoxazolin-4-ylidene)ammonium chloride Formula: C10H10ClN3O2 MolecularWeight: 239.6583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=O)C1=[NH+]NC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC\1=NOC(=O)/C1=[NH+]/NC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C10H9N3O2.ClH/c1-7-9(10(14)15-13-7)12-11-8-5-3-2-4-6-8;/h2-6,11H,1H3;1H/b12-9+;