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

Systemtic Name: 8-(4-methylpiperazin-1-yl)-3-nitro-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Openeye Name: 8-(4-methylpiperazin-1-yl)-3-nitro-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium CAS Name: 8-(4-methyl-1-piperazinyl)-3-nitro-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium IUPAC Name: 8-(4-methylpiperazin-1-yl)-3-nitro-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Traditional Name: 8-(4-methylpiperazino)-3-nitro-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Formula: C14H15N7O3 MolecularWeight: 329.314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N7O3/c1-17-4-6-18(7-5-17)10-2-3-11-12(8-10)19-14(16-20(11)22)13(9-15-19)21(23)24/h2-3,8-9H,4-7H2,1H3