1-(2-tert-butylsulfonylphenyl)-2-nitro-benzene

Systemtic Name: 1-(2-tert-butylsulfonylphenyl)-2-nitro-benzene Openeye Name: 1-(2-tert-butylsulfonylphenyl)-2-nitro-benzene CAS Name: 1-(2-tert-butylsulfonylphenyl)-2-nitrobenzene IUPAC Name: 1-(2-tert-butylsulfonylphenyl)-2-nitrobenzene Traditional Name: 1-(2-tert-butylsulfonylphenyl)-2-nitro-benzene Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)C1=CC=CC=C1C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)S(=O)(=O)C1=CC=CC=C1C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H17NO4S/c1-16(2,3)22(20,21)15-11-7-5-9-13(15)12-8-4-6-10-14(12)17(18)19/h4-11H,1-3H3