4-ethanoyl-N-[(E)-(1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl)methylideneamino]benzamide

Systemtic Name: 4-ethanoyl-N-[(E)-(1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl)methylideneamino]benzamide Openeye Name: 4-acetyl-N-[(E)-(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)methyleneamino]benzamide CAS Name: 4-acetyl-N-[(E)-(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)methylideneamino]benzamide IUPAC Name: 4-acetyl-N-[(E)-(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)methylideneamino]benzamide Traditional Name: 4-acetyl-N-[(E)-(1-oxidobenzofurazan-1-ium-5-yl)methyleneamino]benzamide Formula: C16H12N4O4 MolecularWeight: 324.29088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C(=O)NN=CC2=CC3=NO[N+](=C3C=C2)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C(=O)N/N=C/C2=CC3=NO[N+](=C3C=C2)[O-]

InChI

InChI=1S/C16H12N4O4/c1-10(21)12-3-5-13(6-4-12)16(22)18-17-9-11-2-7-15-14(8-11)19-24-20(15)23/h2-9H,1H3,(H,18,22)/b17-9+