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

Systemtic Name: 7-tert-butyl-3,3-dimethyl-5-nitro-2H-1-benzothiophene Openeye Name: 7-tert-butyl-3,3-dimethyl-5-nitro-2H-benzothiophene CAS Name: 7-tert-butyl-3,3-dimethyl-5-nitro-2H-1-benzothiophene IUPAC Name: 7-tert-butyl-3,3-dimethyl-5-nitro-2H-1-benzothiophene Traditional Name: 7-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(CSC2=C(C=C(C=C21)[N+](=O)[O-])C(C)(C)C)C

Isomeric SMILES

CC1(CSC2=C(C=C(C=C21)[N+](=O)[O-])C(C)(C)C)C

InChI

InChI=1S/C14H19NO2S/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