7-tert-butyl-3,3-dimethyl-5-nitro-2H-1-benzofuran

Systemtic Name: 7-tert-butyl-3,3-dimethyl-5-nitro-2H-1-benzofuran Openeye Name: 7-tert-butyl-3,3-dimethyl-5-nitro-2H-benzofuran CAS Name: 7-tert-butyl-3,3-dimethyl-5-nitro-2H-benzofuran IUPAC Name: 7-tert-butyl-3,3-dimethyl-5-nitro-2H-1-benzofuran Traditional Name: 7-tert-butyl-3,3-dimethyl-5-nitro-coumaran Formula: C14H19NO3 MolecularWeight: 249.30556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C21)[N+](=O)[O-])C(C)(C)C)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C21)[N+](=O)[O-])C(C)(C)C)C

InChI

InChI=1S/C14H19NO3/c1-13(2,3)10-6-9(15(16)17)7-11-12(10)18-8-14(11,4)5/h6-7H,8H2,1-5H3