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

Systemtic Name: 1-(6-ethoxy-5-nitro-pyrimidin-4-yl)azepane Openeye Name: 1-(6-ethoxy-5-nitro-pyrimidin-4-yl)azepane CAS Name: 1-(6-ethoxy-5-nitro-4-pyrimidinyl)azepane IUPAC Name: 1-(6-ethoxy-5-nitropyrimidin-4-yl)azepane Traditional Name: 1-(6-ethoxy-5-nitro-pyrimidin-4-yl)azepane Formula: C12H18N4O3 MolecularWeight: 266.29632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=NC(=C1[N+](=O)[O-])N2CCCCCC2

Isomeric SMILES

CCOC1=NC=NC(=C1[N+](=O)[O-])N2CCCCCC2

InChI

InChI=1S/C12H18N4O3/c1-2-19-12-10(16(17)18)11(13-9-14-12)15-7-5-3-4-6-8-15/h9H,2-8H2,1H3