1-(3,5-dimethylpyrazol-1-yl)-2-(phenylmethyl)butan-1-one

Systemtic Name: 1-(3,5-dimethylpyrazol-1-yl)-2-(phenylmethyl)butan-1-one Openeye Name: 2-benzyl-1-(3,5-dimethylpyrazol-1-yl)butan-1-one CAS Name: 1-(3,5-dimethyl-1-pyrazolyl)-2-(phenylmethyl)-1-butanone IUPAC Name: 2-benzyl-1-(3,5-dimethylpyrazol-1-yl)butan-1-one Traditional Name: 2-benzyl-1-(3,5-dimethylpyrazol-1-yl)butan-1-one Formula: C16H20N2O MolecularWeight: 256.3428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)C(=O)N2C(=CC(=N2)C)C

Isomeric SMILES

CCC(CC1=CC=CC=C1)C(=O)N2C(=CC(=N2)C)C

InChI

InChI=1S/C16H20N2O/c1-4-15(11-14-8-6-5-7-9-14)16(19)18-13(3)10-12(2)17-18/h5-10,15H,4,11H2,1-3H3