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

Systemtic Name: azepan-1-yl-(1-ethyl-4-nitro-pyrazol-3-yl)methanone Openeye Name: azepan-1-yl-(1-ethyl-4-nitro-pyrazol-3-yl)methanone CAS Name: 1-azepanyl-(1-ethyl-4-nitro-3-pyrazolyl)methanone IUPAC Name: azepan-1-yl-(1-ethyl-4-nitropyrazol-3-yl)methanone Traditional Name: azepan-1-yl-(1-ethyl-4-nitro-pyrazol-3-yl)methanone Formula: C12H18N4O3 MolecularWeight: 266.29632

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)N2CCCCCC2)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N2CCCCCC2)[N+](=O)[O-]

InChI

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