3-nitro-1-pyridin-3-yl-5H-1,2,4-benzotriazepin-4-ide

Systemtic Name: 3-nitro-1-pyridin-3-yl-5H-1,2,4-benzotriazepin-4-ide Openeye Name: 3-nitro-1-(3-pyridyl)-5H-1,2,4-benzotriazepin-4-ide CAS Name: 3-nitro-1-(3-pyridinyl)-5H-1,2,4-benzotriazepin-4-ide IUPAC Name: 3-nitro-1-pyridin-3-yl-5H-1,2,4-benzotriazepin-4-ide Traditional Name: 3-nitro-1-(3-pyridyl)-5H-1,2,4-benzotriazepin-4-ide Formula: C13H10N5O2- MolecularWeight: 268.2508

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N(N=C([N-]1)[N+](=O)[O-])C3=CN=CC=C3

Isomeric SMILES

C1C2=CC=CC=C2N(N=C([N-]1)[N+](=O)[O-])C3=CN=CC=C3

InChI

InChI=1S/C13H10N5O2/c19-18(20)13-15-8-10-4-1-2-6-12(10)17(16-13)11-5-3-7-14-9-11/h1-7,9H,8H2/q-1