4-nitro-1-(2,4,6-trimethylphenyl)sulfonyl-imidazole

Systemtic Name: 4-nitro-1-(2,4,6-trimethylphenyl)sulfonyl-imidazole Openeye Name: 4-nitro-1-(2,4,6-trimethylphenyl)sulfonyl-imidazole CAS Name: 4-nitro-1-(2,4,6-trimethylphenyl)sulfonylimidazole IUPAC Name: 4-nitro-1-(2,4,6-trimethylphenyl)sulfonylimidazole Traditional Name: 1-mesitylsulfonyl-4-nitro-imidazole Formula: C12H13N3O4S MolecularWeight: 295.31432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C=C(N=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C=C(N=C2)[N+](=O)[O-])C

InChI

InChI=1S/C12H13N3O4S/c1-8-4-9(2)12(10(3)5-8)20(18,19)14-6-11(13-7-14)15(16)17/h4-7H,1-3H3