1-(6-methyl-4-nitro-pyridin-2-yl)azepane

Systemtic Name: 1-(6-methyl-4-nitro-pyridin-2-yl)azepane Openeye Name: 1-(6-methyl-4-nitro-2-pyridyl)azepane CAS Name: 1-(6-methyl-4-nitro-2-pyridinyl)azepane IUPAC Name: 1-(6-methyl-4-nitropyridin-2-yl)azepane Traditional Name: 1-(6-methyl-4-nitro-2-pyridyl)azepane Formula: C12H17N3O2 MolecularWeight: 235.28228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=C1)[N+](=O)[O-])N2CCCCCC2

Isomeric SMILES

CC1=NC(=CC(=C1)[N+](=O)[O-])N2CCCCCC2

InChI

InChI=1S/C12H17N3O2/c1-10-8-11(15(16)17)9-12(13-10)14-6-4-2-3-5-7-14/h8-9H,2-7H2,1H3