N-[(2S)-3-methyl-1-oxidanyl-butan-2-yl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[(2S)-3-methyl-1-oxidanyl-butan-2-yl]-2-nitro-benzenesulfonamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-2-methyl-propyl]-2-nitro-benzenesulfonamide CAS Name: N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-nitrobenzenesulfonamide IUPAC Name: N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-nitrobenzenesulfonamide Traditional Name: N-[(1S)-2-methyl-1-methylol-propyl]-2-nitro-benzenesulfonamide Formula: C11H16N2O5S MolecularWeight: 288.32014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H](CO)NS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C11H16N2O5S/c1-8(2)9(7-14)12-19(17,18)11-6-4-3-5-10(11)13(15)16/h3-6,8-9,12,14H,7H2,1-2H3/t9-/m1/s1