1-(2,4-dimethylphenyl)sulfonyl-5-nitro-benzotriazole

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-5-nitro-benzotriazole Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-5-nitro-benzotriazole CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-5-nitrobenzotriazole IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-5-nitrobenzotriazole Traditional Name: 1-(2,4-dimethylphenyl)sulfonyl-5-nitro-benzotriazole Formula: C14H12N4O4S MolecularWeight: 332.33448

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C14H12N4O4S/c1-9-3-6-14(10(2)7-9)23(21,22)17-13-5-4-11(18(19)20)8-12(13)15-16-17/h3-8H,1-2H3