1-[3-methyl-1-(phenylmethyl)pyrazol-4-yl]ethanone

Systemtic Name: 1-[3-methyl-1-(phenylmethyl)pyrazol-4-yl]ethanone Openeye Name: 1-(1-benzyl-3-methyl-pyrazol-4-yl)ethanone CAS Name: 1-[3-methyl-1-(phenylmethyl)-4-pyrazolyl]ethanone IUPAC Name: 1-(1-benzyl-3-methylpyrazol-4-yl)ethanone Traditional Name: 1-(1-benzyl-3-methyl-pyrazol-4-yl)ethanone Formula: C13H14N2O MolecularWeight: 214.26306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(=O)C)CC2=CC=CC=C2

Isomeric SMILES

CC1=NN(C=C1C(=O)C)CC2=CC=CC=C2

InChI

InChI=1S/C13H14N2O/c1-10-13(11(2)16)9-15(14-10)8-12-6-4-3-5-7-12/h3-7,9H,8H2,1-2H3