5-oxidanidyl-8-phenethyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium

Systemtic Name: 5-oxidanidyl-8-phenethyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Openeye Name: 5-oxido-8-phenethyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium CAS Name: 5-oxido-8-phenethylpyrazolo[5,1-c][1,2,4]benzotriazin-5-ium IUPAC Name: 5-oxido-8-phenethylpyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Traditional Name: 5-oxido-8-phenethyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Formula: C17H14N4O MolecularWeight: 290.31926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC3=C(C=C2)[N+](=NC4=CC=NN43)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC3=C(C=C2)[N+](=NC4=CC=NN43)[O-]

InChI

InChI=1S/C17H14N4O/c22-21-15-9-8-14(7-6-13-4-2-1-3-5-13)12-16(15)20-17(19-21)10-11-18-20/h1-5,8-12H,6-7H2