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

Systemtic Name: 1-(5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-yl)benzotriazole Openeye Name: 1-(5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-yl)benzotriazole CAS Name: 1-[5-nitro-6-(1-pyrrolidinyl)-4-pyrimidinyl]benzotriazole IUPAC Name: 1-(5-nitro-6-pyrrolidin-1-ylpyrimidin-4-yl)benzotriazole Traditional Name: 1-(5-nitro-6-pyrrolidino-pyrimidin-4-yl)benzotriazole Formula: C14H13N7O2 MolecularWeight: 311.29872

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CCN(C1)C2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C14H13N7O2/c22-21(23)12-13(19-7-3-4-8-19)15-9-16-14(12)20-11-6-2-1-5-10(11)17-18-20/h1-2,5-6,9H,3-4,7-8H2