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

Systemtic Name: azepan-1-yl-(4-iodanyl-1-methyl-pyrazol-3-yl)methanone Openeye Name: azepan-1-yl-(4-iodo-1-methyl-pyrazol-3-yl)methanone CAS Name: 1-azepanyl-(4-iodo-1-methyl-3-pyrazolyl)methanone IUPAC Name: azepan-1-yl-(4-iodo-1-methylpyrazol-3-yl)methanone Traditional Name: azepan-1-yl-(4-iodo-1-methyl-pyrazol-3-yl)methanone Formula: C11H16IN3O MolecularWeight: 333.16871

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)N2CCCCCC2)I

Isomeric SMILES

CN1C=C(C(=N1)C(=O)N2CCCCCC2)I

InChI

InChI=1S/C11H16IN3O/c1-14-8-9(12)10(13-14)11(16)15-6-4-2-3-5-7-15/h8H,2-7H2,1H3