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

Systemtic Name: 1-[(4-bromophenyl)methyl]-3-phenyl-pyrazole-4-carbaldehyde Openeye Name: 1-[(4-bromophenyl)methyl]-3-phenyl-pyrazole-4-carbaldehyde CAS Name: 1-[(4-bromophenyl)methyl]-3-phenyl-4-pyrazolecarboxaldehyde IUPAC Name: 1-[(4-bromophenyl)methyl]-3-phenylpyrazole-4-carbaldehyde Traditional Name: 1-(4-bromobenzyl)-3-phenyl-pyrazole-4-carbaldehyde Formula: C17H13BrN2O MolecularWeight: 341.20192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=O)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C=O)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H13BrN2O/c18-16-8-6-13(7-9-16)10-20-11-15(12-21)17(19-20)14-4-2-1-3-5-14/h1-9,11-12H,10H2