1-(4-methylphenyl)sulfonyl-5-nitro-benzotriazole

Systemtic Name: 1-(4-methylphenyl)sulfonyl-5-nitro-benzotriazole Openeye Name: 5-nitro-1-(p-tolylsulfonyl)benzotriazole CAS Name: 1-(4-methylphenyl)sulfonyl-5-nitrobenzotriazole IUPAC Name: 1-(4-methylphenyl)sulfonyl-5-nitrobenzotriazole Traditional Name: 5-nitro-1-tosyl-benzotriazole Formula: C13H10N4O4S MolecularWeight: 318.3079

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)[N+](=O)[O-])N=N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)[N+](=O)[O-])N=N2

InChI

InChI=1S/C13H10N4O4S/c1-9-2-5-11(6-3-9)22(20,21)16-13-7-4-10(17(18)19)8-12(13)14-15-16/h2-8H,1H3