azepan-1-yl-(1,5-dimethyl-4-nitro-pyrazol-3-yl)methanone

Systemtic Name: azepan-1-yl-(1,5-dimethyl-4-nitro-pyrazol-3-yl)methanone Openeye Name: azepan-1-yl-(1,5-dimethyl-4-nitro-pyrazol-3-yl)methanone CAS Name: 1-azepanyl-(1,5-dimethyl-4-nitro-3-pyrazolyl)methanone IUPAC Name: azepan-1-yl-(1,5-dimethyl-4-nitropyrazol-3-yl)methanone Traditional Name: azepan-1-yl-(1,5-dimethyl-4-nitro-pyrazol-3-yl)methanone Formula: C12H18N4O3 MolecularWeight: 266.29632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)N2CCCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)N2CCCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C12H18N4O3/c1-9-11(16(18)19)10(13-14(9)2)12(17)15-7-5-3-4-6-8-15/h3-8H2,1-2H3