1-[bis(iodanyl)methylsulfonyl]-4-methyl-2-nitro-benzene

Systemtic Name: 1-[bis(iodanyl)methylsulfonyl]-4-methyl-2-nitro-benzene Openeye Name: 1-(diiodomethylsulfonyl)-4-methyl-2-nitro-benzene CAS Name: 1-(diiodomethylsulfonyl)-4-methyl-2-nitrobenzene IUPAC Name: 1-(diiodomethylsulfonyl)-4-methyl-2-nitrobenzene Traditional Name: 1-(diiodomethylsulfonyl)-4-methyl-2-nitro-benzene Formula: C8H7I2NO4S MolecularWeight: 467.01942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7I2NO4S/c1-5-2-3-7(6(4-5)11(12)13)16(14,15)8(9)10/h2-4,8H,1H3