1-[3-[(4-bromophenyl)methyl]-5-methyl-1-propyl-pyrazol-4-yl]ethanone

Systemtic Name: 1-[3-[(4-bromophenyl)methyl]-5-methyl-1-propyl-pyrazol-4-yl]ethanone Openeye Name: 1-[3-[(4-bromophenyl)methyl]-5-methyl-1-propyl-pyrazol-4-yl]ethanone CAS Name: 1-[3-[(4-bromophenyl)methyl]-5-methyl-1-propyl-4-pyrazolyl]ethanone IUPAC Name: 1-[3-[(4-bromophenyl)methyl]-5-methyl-1-propylpyrazol-4-yl]ethanone Traditional Name: 1-[3-(4-bromobenzyl)-5-methyl-1-propyl-pyrazol-4-yl]ethanone Formula: C16H19BrN2O MolecularWeight: 335.23886

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=N1)CC2=CC=C(C=C2)Br)C(=O)C)C

Isomeric SMILES

CCCN1C(=C(C(=N1)CC2=CC=C(C=C2)Br)C(=O)C)C

InChI

InChI=1S/C16H19BrN2O/c1-4-9-19-11(2)16(12(3)20)15(18-19)10-13-5-7-14(17)8-6-13/h5-8H,4,9-10H2,1-3H3