1-(5-nitro-6-piperidin-1-yl-pyrimidin-4-yl)benzotriazole

Systemtic Name: 1-(5-nitro-6-piperidin-1-yl-pyrimidin-4-yl)benzotriazole Openeye Name: 1-[5-nitro-6-(1-piperidyl)pyrimidin-4-yl]benzotriazole CAS Name: 1-[5-nitro-6-(1-piperidinyl)-4-pyrimidinyl]benzotriazole IUPAC Name: 1-(5-nitro-6-piperidin-1-ylpyrimidin-4-yl)benzotriazole Traditional Name: 1-(5-nitro-6-piperidino-pyrimidin-4-yl)benzotriazole Formula: C15H15N7O2 MolecularWeight: 325.3253

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C15H15N7O2/c23-22(24)13-14(20-8-4-1-5-9-20)16-10-17-15(13)21-12-7-3-2-6-11(12)18-19-21/h2-3,6-7,10H,1,4-5,8-9H2