1-[2-(2,4-dichlorophenyl)-3-methyl-butyl]-1,2,4-triazole nitrate

Systemtic Name: 1-[2-(2,4-dichlorophenyl)-3-methyl-butyl]-1,2,4-triazole nitrate Openeye Name: 1-[2-(2,4-dichlorophenyl)-3-methyl-butyl]-1,2,4-triazole nitrate CAS Name: 1-[2-(2,4-dichlorophenyl)-3-methylbutyl]-1,2,4-triazole nitrate IUPAC Name: 1-[2-(2,4-dichlorophenyl)-3-methylbutyl]-1,2,4-triazole nitrate Traditional Name: 1-[2-(2,4-dichlorophenyl)-3-methyl-butyl]-1,2,4-triazole nitrate Formula: C13H15Cl2N4O3- MolecularWeight: 346.1892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15Cl2N3.NO3/c1-9(2)12(6-18-8-16-7-17-18)11-4-3-10(14)5-13(11)15;2-1(3)4/h3-5,7-9,12H,6H2,1-2H3;/q;-1