1-(8-bromanyloctyl)-3,4,5-triphenyl-pyrazole

Systemtic Name: 1-(8-bromanyloctyl)-3,4,5-triphenyl-pyrazole Openeye Name: 1-(8-bromooctyl)-3,4,5-triphenyl-pyrazole CAS Name: 1-(8-bromooctyl)-3,4,5-triphenylpyrazole IUPAC Name: 1-(8-bromooctyl)-3,4,5-triphenylpyrazole Traditional Name: 1-(8-bromooctyl)-3,4,5-triphenyl-pyrazole Formula: C29H31BrN2 MolecularWeight: 487.47384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=CC=C3)CCCCCCCCBr)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=CC=C3)CCCCCCCCBr)C4=CC=CC=C4

InChI

InChI=1S/C29H31BrN2/c30-22-14-3-1-2-4-15-23-32-29(26-20-12-7-13-21-26)27(24-16-8-5-9-17-24)28(31-32)25-18-10-6-11-19-25/h5-13,16-21H,1-4,14-15,22-23H2