2-tert-butyl-3,3-dimethyl-5-nitro-2H-1-benzothiophene

Systemtic Name: 2-tert-butyl-3,3-dimethyl-5-nitro-2H-1-benzothiophene Openeye Name: 2-tert-butyl-3,3-dimethyl-5-nitro-2H-benzothiophene CAS Name: 2-tert-butyl-3,3-dimethyl-5-nitro-2H-1-benzothiophene IUPAC Name: 2-tert-butyl-3,3-dimethyl-5-nitro-2H-1-benzothiophene Traditional Name: 2-tert-butyl-3,3-dimethyl-5-nitro-2H-benzothiophene Formula: C14H19NO2S MolecularWeight: 265.37116

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(SC2=C1C=C(C=C2)[N+](=O)[O-])C(C)(C)C)C

Isomeric SMILES

CC1(C(SC2=C1C=C(C=C2)[N+](=O)[O-])C(C)(C)C)C

InChI

InChI=1S/C14H19NO2S/c1-13(2,3)12-14(4,5)10-8-9(15(16)17)6-7-11(10)18-12/h6-8,12H,1-5H3