4-(chloromethyl)-2-(2,4-dinitrophenyl)-5-nitro-1,2,3-triazole

Systemtic Name: 4-(chloromethyl)-2-(2,4-dinitrophenyl)-5-nitro-1,2,3-triazole Openeye Name: 4-(chloromethyl)-2-(2,4-dinitrophenyl)-5-nitro-triazole CAS Name: 4-(chloromethyl)-2-(2,4-dinitrophenyl)-5-nitrotriazole IUPAC Name: 4-(chloromethyl)-2-(2,4-dinitrophenyl)-5-nitrotriazole Traditional Name: 4-(chloromethyl)-2-(2,4-dinitrophenyl)-5-nitro-triazole Formula: C9H5ClN6O6 MolecularWeight: 328.6256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N2N=C(C(=N2)[N+](=O)[O-])CCl

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N2N=C(C(=N2)[N+](=O)[O-])CCl

InChI

InChI=1S/C9H5ClN6O6/c10-4-6-9(16(21)22)12-13(11-6)7-2-1-5(14(17)18)3-8(7)15(19)20/h1-3H,4H2