6-(benzotriazol-1-yl)-N-methyl-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(benzotriazol-1-yl)-N-methyl-5-nitro-pyrimidin-4-amine Openeye Name: 6-(benzotriazol-1-yl)-N-methyl-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-benzotriazolyl)-N-methyl-5-nitro-4-pyrimidinamine IUPAC Name: 6-(benzotriazol-1-yl)-N-methyl-5-nitropyrimidin-4-amine Traditional Name: [6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C11H9N7O2 MolecularWeight: 271.23486

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC(=C1[N+](=O)[O-])N2C3=CC=CC=C3N=N2

Isomeric SMILES

CNC1=NC=NC(=C1[N+](=O)[O-])N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C11H9N7O2/c1-12-10-9(18(19)20)11(14-6-13-10)17-8-5-3-2-4-7(8)15-16-17/h2-6H,1H3,(H,12,13,14)