2-methyl-1-(4-methylsulfanylphenyl)-2-nitro-propan-1-ol

Systemtic Name: 2-methyl-1-(4-methylsulfanylphenyl)-2-nitro-propan-1-ol Openeye Name: 2-methyl-1-(4-methylsulfanylphenyl)-2-nitro-propan-1-ol CAS Name: 2-methyl-1-[4-(methylthio)phenyl]-2-nitro-1-propanol IUPAC Name: 2-methyl-1-(4-methylsulfanylphenyl)-2-nitropropan-1-ol Traditional Name: 2-methyl-1-[4-(methylthio)phenyl]-2-nitro-propan-1-ol Formula: C11H15NO3S MolecularWeight: 241.3067

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO3S/c1-11(2,12(14)15)10(13)8-4-6-9(16-3)7-5-8/h4-7,10,13H,1-3H3