3,5-dimethyl-4-(5-nitrobenzotriazol-1-yl)sulfonyl-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-(5-nitrobenzotriazol-1-yl)sulfonyl-1,2-oxazole Openeye Name: 3,5-dimethyl-4-(5-nitrobenzotriazol-1-yl)sulfonyl-isoxazole CAS Name: 3,5-dimethyl-4-[(5-nitro-1-benzotriazolyl)sulfonyl]isoxazole IUPAC Name: 3,5-dimethyl-4-(5-nitrobenzotriazol-1-yl)sulfonyl-1,2-oxazole Traditional Name: 3,5-dimethyl-4-(5-nitrobenzotriazol-1-yl)sulfonyl-isoxazole Formula: C11H9N5O5S MolecularWeight: 323.28466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2C3=C(C=C(C=C3)[N+](=O)[O-])N=N2

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2C3=C(C=C(C=C3)[N+](=O)[O-])N=N2

InChI

InChI=1S/C11H9N5O5S/c1-6-11(7(2)21-13-6)22(19,20)15-10-4-3-8(16(17)18)5-9(10)12-14-15/h3-5H,1-2H3