3-(4-methylphenyl)-5-(trinitromethyl)-1,2,4-oxadiazole

Systemtic Name: 3-(4-methylphenyl)-5-(trinitromethyl)-1,2,4-oxadiazole Openeye Name: 3-(p-tolyl)-5-(trinitromethyl)-1,2,4-oxadiazole CAS Name: 3-(4-methylphenyl)-5-(trinitromethyl)-1,2,4-oxadiazole IUPAC Name: 3-(4-methylphenyl)-5-(trinitromethyl)-1,2,4-oxadiazole Traditional Name: 3-(p-tolyl)-5-(trinitromethyl)-1,2,4-oxadiazole Formula: C10H7N5O7 MolecularWeight: 309.19188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H7N5O7/c1-6-2-4-7(5-3-6)8-11-9(22-12-8)10(13(16)17,14(18)19)15(20)21/h2-5H,1H3