azepan-1-yl-(1-methyl-4-nitro-pyrazol-3-yl)methanone

Systemtic Name: azepan-1-yl-(1-methyl-4-nitro-pyrazol-3-yl)methanone Openeye Name: azepan-1-yl-(1-methyl-4-nitro-pyrazol-3-yl)methanone CAS Name: 1-azepanyl-(1-methyl-4-nitro-3-pyrazolyl)methanone IUPAC Name: azepan-1-yl-(1-methyl-4-nitropyrazol-3-yl)methanone Traditional Name: azepan-1-yl-(1-methyl-4-nitro-pyrazol-3-yl)methanone Formula: C11H16N4O3 MolecularWeight: 252.26974

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)N2CCCCCC2)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C(=N1)C(=O)N2CCCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C11H16N4O3/c1-13-8-9(15(17)18)10(12-13)11(16)14-6-4-2-3-5-7-14/h8H,2-7H2,1H3