1,2-dimethyl-4-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-benzene

Systemtic Name: 1,2-dimethyl-4-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-benzene Openeye Name: 1,2-dimethyl-4-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-benzene CAS Name: 1,2-dimethyl-4-[(4-methylsulfonyl-2-nitrophenyl)thio]benzene IUPAC Name: 1,2-dimethyl-4-(4-methylsulfonyl-2-nitrophenyl)sulfanylbenzene Traditional Name: 4-[(4-mesyl-2-nitro-phenyl)thio]-1,2-dimethyl-benzene Formula: C15H15NO4S2 MolecularWeight: 337.4139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C

InChI

InChI=1S/C15H15NO4S2/c1-10-4-5-12(8-11(10)2)21-15-7-6-13(22(3,19)20)9-14(15)16(17)18/h4-9H,1-3H3