(4-butylphenyl)-(3,5-dimethylpyrazol-1-yl)methanone

Systemtic Name: (4-butylphenyl)-(3,5-dimethylpyrazol-1-yl)methanone Openeye Name: (4-butylphenyl)-(3,5-dimethylpyrazol-1-yl)methanone CAS Name: (4-butylphenyl)-(3,5-dimethyl-1-pyrazolyl)methanone IUPAC Name: (4-butylphenyl)-(3,5-dimethylpyrazol-1-yl)methanone Traditional Name: (4-butylphenyl)-(3,5-dimethylpyrazol-1-yl)methanone Formula: C16H20N2O MolecularWeight: 256.3428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N2C(=CC(=N2)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N2C(=CC(=N2)C)C

InChI

InChI=1S/C16H20N2O/c1-4-5-6-14-7-9-15(10-8-14)16(19)18-13(3)11-12(2)17-18/h7-11H,4-6H2,1-3H3