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

Systemtic Name: 6-(benzotriazol-1-yl)-N-cycloheptyl-5-nitro-pyrimidin-4-amine Openeye Name: 6-(benzotriazol-1-yl)-N-cycloheptyl-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-benzotriazolyl)-N-cycloheptyl-5-nitro-4-pyrimidinamine IUPAC Name: 6-(benzotriazol-1-yl)-N-cycloheptyl-5-nitropyrimidin-4-amine Traditional Name: [6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-cycloheptyl-amine Formula: C17H19N7O2 MolecularWeight: 353.37846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CCCC(CC1)NC2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C17H19N7O2/c25-24(26)15-16(20-12-7-3-1-2-4-8-12)18-11-19-17(15)23-14-10-6-5-9-13(14)21-22-23/h5-6,9-12H,1-4,7-8H2,(H,18,19,20)