1-tert-butyl-2-(nitromethylsulfanyl)benzene

Systemtic Name: 1-tert-butyl-2-(nitromethylsulfanyl)benzene Openeye Name: 1-tert-butyl-2-(nitromethylsulfanyl)benzene CAS Name: 1-tert-butyl-2-(nitromethylthio)benzene IUPAC Name: 1-tert-butyl-2-(nitromethylsulfanyl)benzene Traditional Name: 1-tert-butyl-2-(nitromethylthio)benzene Formula: C11H15NO2S MolecularWeight: 225.3073

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1SC[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1SC[N+](=O)[O-]

InChI

InChI=1S/C11H15NO2S/c1-11(2,3)9-6-4-5-7-10(9)15-8-12(13)14/h4-7H,8H2,1-3H3