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

Systemtic Name: 1-(6-cyclohexyloxy-5-nitro-pyrimidin-4-yl)azepane Openeye Name: 1-[6-(cyclohexoxy)-5-nitro-pyrimidin-4-yl]azepane CAS Name: 1-(6-cyclohexyloxy-5-nitro-4-pyrimidinyl)azepane IUPAC Name: 1-(6-cyclohexyloxy-5-nitropyrimidin-4-yl)azepane Traditional Name: 1-[6-(cyclohexoxy)-5-nitro-pyrimidin-4-yl]azepane Formula: C16H24N4O3 MolecularWeight: 320.38676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C(=NC=N2)OC3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=NC=N2)OC3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H24N4O3/c21-20(22)14-15(19-10-6-1-2-7-11-19)17-12-18-16(14)23-13-8-4-3-5-9-13/h12-13H,1-11H2