3-chloranyl-6-ethoxy-1-oxidanidyl-1,2,4-benzotriazin-1-ium

Systemtic Name: 3-chloranyl-6-ethoxy-1-oxidanidyl-1,2,4-benzotriazin-1-ium Openeye Name: 3-chloro-6-ethoxy-1-oxido-1,2,4-benzotriazin-1-ium CAS Name: 3-chloro-6-ethoxy-1-oxido-1,2,4-benzotriazin-1-ium IUPAC Name: 3-chloro-6-ethoxy-1-oxido-1,2,4-benzotriazin-1-ium Traditional Name: 3-chloro-6-ethoxy-1-oxido-1,2,4-benzotriazin-1-ium Formula: C9H8ClN3O2 MolecularWeight: 225.63172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)[N+](=NC(=N2)Cl)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)[N+](=NC(=N2)Cl)[O-]

InChI

InChI=1S/C9H8ClN3O2/c1-2-15-6-3-4-8-7(5-6)11-9(10)12-13(8)14/h3-5H,2H2,1H3