1,2-dimethyl-3-(4-methylsulfonyl-2-nitro-phenoxy)benzene

Systemtic Name: 1,2-dimethyl-3-(4-methylsulfonyl-2-nitro-phenoxy)benzene Openeye Name: 1,2-dimethyl-3-(4-methylsulfonyl-2-nitro-phenoxy)benzene CAS Name: 1,2-dimethyl-3-(4-methylsulfonyl-2-nitrophenoxy)benzene IUPAC Name: 1,2-dimethyl-3-(4-methylsulfonyl-2-nitrophenoxy)benzene Traditional Name: 1-(4-mesyl-2-nitro-phenoxy)-2,3-dimethyl-benzene Formula: C15H15NO5S MolecularWeight: 321.3483

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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-])C

Isomeric SMILES

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

InChI

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