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

Systemtic Name: azepan-1-yl-(4-bromanyl-1-ethyl-pyrazol-3-yl)methanone Openeye Name: azepan-1-yl-(4-bromo-1-ethyl-pyrazol-3-yl)methanone CAS Name: 1-azepanyl-(4-bromo-1-ethyl-3-pyrazolyl)methanone IUPAC Name: azepan-1-yl-(4-bromo-1-ethylpyrazol-3-yl)methanone Traditional Name: azepan-1-yl-(4-bromo-1-ethyl-pyrazol-3-yl)methanone Formula: C12H18BrN3O MolecularWeight: 300.19482

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)N2CCCCCC2)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N2CCCCCC2)Br

InChI

InChI=1S/C12H18BrN3O/c1-2-16-9-10(13)11(14-16)12(17)15-7-5-3-4-6-8-15/h9H,2-8H2,1H3