8-(4-methylpiperazin-1-yl)-5-oxidanidyl-3-phenyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium

Systemtic Name: 8-(4-methylpiperazin-1-yl)-5-oxidanidyl-3-phenyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Openeye Name: 8-(4-methylpiperazin-1-yl)-5-oxido-3-phenyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium CAS Name: 8-(4-methyl-1-piperazinyl)-5-oxido-3-phenylpyrazolo[5,1-c][1,2,4]benzotriazin-5-ium IUPAC Name: 8-(4-methylpiperazin-1-yl)-5-oxido-3-phenylpyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Traditional Name: 8-(4-methylpiperazino)-5-oxido-3-phenyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Formula: C20H20N6O MolecularWeight: 360.4124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=C(C=C2)[N+](=NC4=C(C=NN34)C5=CC=CC=C5)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=CC3=C(C=C2)[N+](=NC4=C(C=NN34)C5=CC=CC=C5)[O-]

InChI

InChI=1S/C20H20N6O/c1-23-9-11-24(12-10-23)16-7-8-18-19(13-16)25-20(22-26(18)27)17(14-21-25)15-5-3-2-4-6-15/h2-8,13-14H,9-12H2,1H3