2-methyl-4-(4-methylsulfonyl-2-nitro-phenoxy)-1-nitro-benzene

Systemtic Name: 2-methyl-4-(4-methylsulfonyl-2-nitro-phenoxy)-1-nitro-benzene Openeye Name: 2-methyl-4-(4-methylsulfonyl-2-nitro-phenoxy)-1-nitro-benzene CAS Name: 2-methyl-4-(4-methylsulfonyl-2-nitrophenoxy)-1-nitrobenzene IUPAC Name: 2-methyl-4-(4-methylsulfonyl-2-nitrophenoxy)-1-nitrobenzene Traditional Name: 4-(4-mesyl-2-nitro-phenoxy)-2-methyl-1-nitro-benzene Formula: C14H12N2O7S MolecularWeight: 352.31928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O7S/c1-9-7-10(3-5-12(9)15(17)18)23-14-6-4-11(24(2,21)22)8-13(14)16(19)20/h3-8H,1-2H3