N-ethyl-6-nitro-3-oxidanidyl-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine

Systemtic Name: N-ethyl-6-nitro-3-oxidanidyl-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine Openeye Name: N-ethyl-6-nitro-3-oxido-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine CAS Name: N-ethyl-6-nitro-3-oxido-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine IUPAC Name: N-ethyl-6-nitro-3-oxido-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine Traditional Name: ethyl-(6-nitro-3-oxido-benzofurazan-3-ium-5-yl)-phenyl-amine Formula: C14H12N4O4 MolecularWeight: 300.26948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=CC3=[N+](ON=C3C=C2[N+](=O)[O-])[O-]

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=CC3=[N+](ON=C3C=C2[N+](=O)[O-])[O-]

InChI

InChI=1S/C14H12N4O4/c1-2-16(10-6-4-3-5-7-10)13-9-12-11(15-22-18(12)21)8-14(13)17(19)20/h3-9H,2H2,1H3