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

Systemtic Name: 1-(1-phenylpyrazol-4-yl)octan-1-one Openeye Name: 1-(1-phenylpyrazol-4-yl)octan-1-one CAS Name: 1-(1-phenyl-4-pyrazolyl)-1-octanone IUPAC Name: 1-(1-phenylpyrazol-4-yl)octan-1-one Traditional Name: 1-(1-phenylpyrazol-4-yl)octan-1-one Formula: C17H22N2O MolecularWeight: 270.36938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCC(=O)C1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C17H22N2O/c1-2-3-4-5-9-12-17(20)15-13-18-19(14-15)16-10-7-6-8-11-16/h6-8,10-11,13-14H,2-5,9,12H2,1H3