1-(3,5-dimethylphenoxy)-4-methylsulfonyl-2-nitro-benzene

Systemtic Name: 1-(3,5-dimethylphenoxy)-4-methylsulfonyl-2-nitro-benzene Openeye Name: 1-(3,5-dimethylphenoxy)-4-methylsulfonyl-2-nitro-benzene CAS Name: 1-(3,5-dimethylphenoxy)-4-methylsulfonyl-2-nitrobenzene IUPAC Name: 1-(3,5-dimethylphenoxy)-4-methylsulfonyl-2-nitrobenzene Traditional Name: 1-(3,5-dimethylphenoxy)-4-mesyl-2-nitro-benzene Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C

InChI

InChI=1S/C15H15NO5S/c1-10-6-11(2)8-12(7-10)21-15-5-4-13(22(3,19)20)9-14(15)16(17)18/h4-9H,1-3H3