1-(6-bromanylhexyl)-3,4,5-triphenyl-pyrazole

Systemtic Name: 1-(6-bromanylhexyl)-3,4,5-triphenyl-pyrazole Openeye Name: 1-(6-bromohexyl)-3,4,5-triphenyl-pyrazole CAS Name: 1-(6-bromohexyl)-3,4,5-triphenylpyrazole IUPAC Name: 1-(6-bromohexyl)-3,4,5-triphenylpyrazole Traditional Name: 1-(6-bromohexyl)-3,4,5-triphenyl-pyrazole Formula: C27H27BrN2 MolecularWeight: 459.42068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27BrN2/c28-20-12-1-2-13-21-30-27(24-18-10-5-11-19-24)25(22-14-6-3-7-15-22)26(29-30)23-16-8-4-9-17-23/h3-11,14-19H,1-2,12-13,20-21H2