5-[(4-bromophenyl)methyl]-1-butyl-3-methyl-pyrazole-4-carbaldehyde

Systemtic Name: 5-[(4-bromophenyl)methyl]-1-butyl-3-methyl-pyrazole-4-carbaldehyde Openeye Name: 5-[(4-bromophenyl)methyl]-1-butyl-3-methyl-pyrazole-4-carbaldehyde CAS Name: 5-[(4-bromophenyl)methyl]-1-butyl-3-methyl-4-pyrazolecarboxaldehyde IUPAC Name: 5-[(4-bromophenyl)methyl]-1-butyl-3-methylpyrazole-4-carbaldehyde Traditional Name: 5-(4-bromobenzyl)-1-butyl-3-methyl-pyrazole-4-carbaldehyde Formula: C16H19BrN2O MolecularWeight: 335.23886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=O)CC2=CC=C(C=C2)Br

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C=O)CC2=CC=C(C=C2)Br

InChI

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