2-(2-bromanyl-4-nitro-phenyl)-2-[(3-bromanyl-1,2,4-triazol-4-yl)methyl]hexanenitrile

Systemtic Name: 2-(2-bromanyl-4-nitro-phenyl)-2-[(3-bromanyl-1,2,4-triazol-4-yl)methyl]hexanenitrile Openeye Name: 2-(2-bromo-4-nitro-phenyl)-2-[(3-bromo-1,2,4-triazol-4-yl)methyl]hexanenitrile CAS Name: 2-(2-bromo-4-nitrophenyl)-2-[(3-bromo-1,2,4-triazol-4-yl)methyl]hexanenitrile IUPAC Name: 2-(2-bromo-4-nitrophenyl)-2-[(3-bromo-1,2,4-triazol-4-yl)methyl]hexanenitrile Traditional Name: 2-(2-bromo-4-nitro-phenyl)-2-[(3-bromo-1,2,4-triazol-4-yl)methyl]hexanenitrile Formula: C15H15Br2N5O2 MolecularWeight: 457.1199

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CN1C=NN=C1Br)(C#N)C2=C(C=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCCCC(CN1C=NN=C1Br)(C#N)C2=C(C=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C15H15Br2N5O2/c1-2-3-6-15(8-18,9-21-10-19-20-14(21)17)12-5-4-11(22(23)24)7-13(12)16/h4-5,7,10H,2-3,6,9H2,1H3