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

Systemtic Name: 1-(6-cyclohexyloxy-5-nitro-pyrimidin-4-yl)benzotriazole Openeye Name: 1-[6-(cyclohexoxy)-5-nitro-pyrimidin-4-yl]benzotriazole CAS Name: 1-(6-cyclohexyloxy-5-nitro-4-pyrimidinyl)benzotriazole IUPAC Name: 1-(6-cyclohexyloxy-5-nitropyrimidin-4-yl)benzotriazole Traditional Name: 1-[6-(cyclohexoxy)-5-nitro-pyrimidin-4-yl]benzotriazole Formula: C16H16N6O3 MolecularWeight: 340.33664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H16N6O3/c23-22(24)14-15(21-13-9-5-4-8-12(13)19-20-21)17-10-18-16(14)25-11-6-2-1-3-7-11/h4-5,8-11H,1-3,6-7H2