N-[(2S)-butan-2-yl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[(2S)-butan-2-yl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-N-[(1S)-1-methylpropyl]-3-nitro-benzenesulfonamide CAS Name: N-[(2S)-butan-2-yl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[(2S)-butan-2-yl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-N-[(1S)-1-methylpropyl]-3-nitro-benzenesulfonamide Formula: C11H16N2O4S MolecularWeight: 272.32074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O4S/c1-4-9(3)12-18(16,17)10-6-5-8(2)11(7-10)13(14)15/h5-7,9,12H,4H2,1-3H3/t9-/m0/s1