1,4,7-tris[(4-bromanyl-1H-pyrazol-5-yl)methyl]-1,4,7-triazonane

Systemtic Name: 1,4,7-tris[(4-bromanyl-1H-pyrazol-5-yl)methyl]-1,4,7-triazonane Openeye Name: 1,4,7-tris[(4-bromo-1H-pyrazol-5-yl)methyl]-1,4,7-triazonane CAS Name: 1,4,7-tris[(4-bromo-1H-pyrazol-5-yl)methyl]-1,4,7-triazonane IUPAC Name: 1,4,7-tris[(4-bromo-1H-pyrazol-5-yl)methyl]-1,4,7-triazonane Traditional Name: 1,4,7-tris[(4-bromo-1H-pyrazol-5-yl)methyl]-1,4,7-triazonane Formula: C18H24Br3N9 MolecularWeight: 606.15546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(CCN1CC2=C(C=NN2)Br)CC3=C(C=NN3)Br)CC4=C(C=NN4)Br

Isomeric SMILES

C1CN(CCN(CCN1CC2=C(C=NN2)Br)CC3=C(C=NN3)Br)CC4=C(C=NN4)Br

InChI

InChI=1S/C18H24Br3N9/c19-13-7-22-25-16(13)10-28-1-2-29(11-17-14(20)8-23-26-17)5-6-30(4-3-28)12-18-15(21)9-24-27-18/h7-9H,1-6,10-12H2,(H,22,25)(H,23,26)(H,24,27)