2,2,4,6-tetramethyl-5-(nitromethylsulfonyl)-3H-1-benzofuran

Systemtic Name: 2,2,4,6-tetramethyl-5-(nitromethylsulfonyl)-3H-1-benzofuran Openeye Name: 2,2,4,6-tetramethyl-5-(nitromethylsulfonyl)-3H-benzofuran CAS Name: 2,2,4,6-tetramethyl-5-(nitromethylsulfonyl)-3H-benzofuran IUPAC Name: 2,2,4,6-tetramethyl-5-(nitromethylsulfonyl)-3H-1-benzofuran Traditional Name: 2,2,4,6-tetramethyl-5-(nitromethylsulfonyl)coumaran Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(O2)(C)C)C(=C1S(=O)(=O)C[N+](=O)[O-])C

Isomeric SMILES

CC1=CC2=C(CC(O2)(C)C)C(=C1S(=O)(=O)C[N+](=O)[O-])C

InChI

InChI=1S/C13H17NO5S/c1-8-5-11-10(6-13(3,4)19-11)9(2)12(8)20(17,18)7-14(15)16/h5H,6-7H2,1-4H3