1-[2-(2,4-dichlorophenyl)heptyl]-1,2,4-triazole nitrate

Systemtic Name: 1-[2-(2,4-dichlorophenyl)heptyl]-1,2,4-triazole nitrate Openeye Name: 1-[2-(2,4-dichlorophenyl)heptyl]-1,2,4-triazole nitrate CAS Name: 1-[2-(2,4-dichlorophenyl)heptyl]-1,2,4-triazole nitrate IUPAC Name: 1-[2-(2,4-dichlorophenyl)heptyl]-1,2,4-triazole nitrate Traditional Name: 1-[2-(2,4-dichlorophenyl)heptyl]-1,2,4-triazole nitrate Formula: C15H19Cl2N4O3- MolecularWeight: 374.24236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CN1C=NC=N1)C2=C(C=C(C=C2)Cl)Cl.[N+](=O)([O-])[O-]

Isomeric SMILES

CCCCCC(CN1C=NC=N1)C2=C(C=C(C=C2)Cl)Cl.[N+](=O)([O-])[O-]

InChI

InChI=1S/C15H19Cl2N3.NO3/c1-2-3-4-5-12(9-20-11-18-10-19-20)14-7-6-13(16)8-15(14)17;2-1(3)4/h6-8,10-12H,2-5,9H2,1H3;/q;-1