5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-(2-methylphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-(2-methylphenyl)-1,2,4-oxadiazole Openeye Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-(o-tolyl)-1,2,4-oxadiazole CAS Name: 5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-3-(2-methylphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-3-(2-methylphenyl)-1,2,4-oxadiazole Traditional Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-(o-tolyl)-1,2,4-oxadiazole Formula: C15H15N5O3 MolecularWeight: 313.3113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NOC(=N2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC=C1C2=NOC(=N2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C15H15N5O3/c1-9-6-4-5-7-12(9)15-16-13(23-18-15)8-19-11(3)14(20(21)22)10(2)17-19/h4-7H,8H2,1-3H3