N-(2-methyl-1-oxidanyl-propan-2-yl)-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-1-oxidanyl-propan-2-yl)-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-(2-hydroxy-1,1-dimethyl-ethyl)-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-(1-hydroxy-2-methylpropan-2-yl)-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-(1-hydroxy-2-methylpropan-2-yl)-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-(2-hydroxy-1,1-dimethyl-ethyl)-2-[(4-nitrophenyl)thio]acetamide Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NC(=O)CSC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CO)NC(=O)CSC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O4S/c1-12(2,8-15)13-11(16)7-19-10-5-3-9(4-6-10)14(17)18/h3-6,15H,7-8H2,1-2H3,(H,13,16)