1-methyl-N-(5-nitropyridin-2-yl)azepan-2-imine

Systemtic Name: 1-methyl-N-(5-nitropyridin-2-yl)azepan-2-imine Openeye Name: 1-methyl-N-(5-nitro-2-pyridyl)azepan-2-imine CAS Name: 1-methyl-N-(5-nitro-2-pyridinyl)-2-azepanimine IUPAC Name: 1-methyl-N-(5-nitropyridin-2-yl)azepan-2-imine Traditional Name: (1-methylazepan-2-ylidene)-(5-nitro-2-pyridyl)amine Formula: C12H16N4O2 MolecularWeight: 248.28104

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCCC1=NC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1CCCCCC1=NC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O2/c1-15-8-4-2-3-5-12(15)14-11-7-6-10(9-13-11)16(17)18/h6-7,9H,2-5,8H2,1H3