1-methyl-4-(4-methyl-3-nitro-phenyl)sulfonyl-2-nitro-benzene

Systemtic Name: 1-methyl-4-(4-methyl-3-nitro-phenyl)sulfonyl-2-nitro-benzene Openeye Name: 1-methyl-4-(4-methyl-3-nitro-phenyl)sulfonyl-2-nitro-benzene CAS Name: 1-methyl-4-(4-methyl-3-nitrophenyl)sulfonyl-2-nitrobenzene IUPAC Name: 1-methyl-4-(4-methyl-3-nitrophenyl)sulfonyl-2-nitrobenzene Traditional Name: 1-methyl-4-(4-methyl-3-nitro-phenyl)sulfonyl-2-nitro-benzene Formula: C14H12N2O6S MolecularWeight: 336.31988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O6S/c1-9-3-5-11(7-13(9)15(17)18)23(21,22)12-6-4-10(2)14(8-12)16(19)20/h3-8H,1-2H3