1-(1-methylpyrazol-4-yl)octan-1-one

Systemtic Name: 1-(1-methylpyrazol-4-yl)octan-1-one Openeye Name: 1-(1-methylpyrazol-4-yl)octan-1-one CAS Name: 1-(1-methyl-4-pyrazolyl)-1-octanone IUPAC Name: 1-(1-methylpyrazol-4-yl)octan-1-one Traditional Name: 1-(1-methylpyrazol-4-yl)octan-1-one Formula: C12H20N2O MolecularWeight: 208.3

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CN(N=C1)C

Isomeric SMILES

CCCCCCCC(=O)C1=CN(N=C1)C

InChI

InChI=1S/C12H20N2O/c1-3-4-5-6-7-8-12(15)11-9-13-14(2)10-11/h9-10H,3-8H2,1-2H3