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4-(2-methylpropylsulfonyl)-6-nitro-2-(trifluoromethyl)-2,3-dihydro-1-benzofuran

4-(2-methylpropylsulfonyl)-6-nitro-2-(trifluoromethyl)-2,3-dihydro-1-benzofuran

Systemtic Name:4-(2-methylpropylsulfonyl)-6-nitro-2-(trifluoromethyl)-2,3-dihydro-1-benzofuran
Openeye Name:4-isobutylsulfonyl-6-nitro-2-(trifluoromethyl)-2,3-dihydrobenzofuran
CAS Name:4-(2-methylpropylsulfonyl)-6-nitro-2-(trifluoromethyl)-2,3-dihydrobenzofuran
IUPAC Name:4-(2-methylpropylsulfonyl)-6-nitro-2-(trifluoromethyl)-2,3-dihydro-1-benzofuran
Traditional Name:4-isobutylsulfonyl-6-nitro-2-(trifluoromethyl)coumaran
Formula: C13H14F3NO5S
MolecularWeight: 353.31417
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)C1=CC(=CC2=C1CC(O2)C(F)(F)F)[N+](=O)[O-]


Isomeric SMILES

CC(C)CS(=O)(=O)C1=CC(=CC2=C1CC(O2)C(F)(F)F)[N+](=O)[O-]


InChI

InChI=1S/C13H14F3NO5S/c1-7(2)6-23(20,21)11-4-8(17(18)19)3-10-9(11)5-12(22-10)13(14,15)16/h3-4,7,12H,5-6H2,1-2H3


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