N-[3-(2-methoxyethyl)phenyl]-1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-3-imine

Systemtic Name: N-[3-(2-methoxyethyl)phenyl]-1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-3-imine Openeye Name: 4-hydroxy-N-[3-(2-methoxyethyl)phenyl]-1-oxido-1,2,4-benzotriazin-1-ium-3-imine CAS Name: 4-hydroxy-N-[3-(2-methoxyethyl)phenyl]-1-oxido-1,2,4-benzotriazin-1-ium-3-imine IUPAC Name: 4-hydroxy-N-[3-(2-methoxyethyl)phenyl]-1-oxido-1,2,4-benzotriazin-1-ium-3-imine Traditional Name: (4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)-[3-(2-methoxyethyl)phenyl]amine Formula: C16H16N4O3 MolecularWeight: 312.32324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCC1=CC(=CC=C1)N=C2N=[N+](C3=CC=CC=C3N2O)[O-]

Isomeric SMILES

COCCC1=CC(=CC=C1)N=C2N=[N+](C3=CC=CC=C3N2O)[O-]

InChI

InChI=1S/C16H16N4O3/c1-23-10-9-12-5-4-6-13(11-12)17-16-18-20(22)15-8-3-2-7-14(15)19(16)21/h2-8,11,21H,9-10H2,1H3