4-methyl-3-nitro-N-(1-oxidanylbutan-2-yl)benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-(1-oxidanylbutan-2-yl)benzenesulfonamide Openeye Name: N-[1-(hydroxymethyl)propyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(1-hydroxybutan-2-yl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(1-hydroxybutan-2-yl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-N-(1-methylolpropyl)-3-nitro-benzenesulfonamide Formula: C11H16N2O5S MolecularWeight: 288.32014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O5S/c1-3-9(7-14)12-19(17,18)10-5-4-8(2)11(6-10)13(15)16/h4-6,9,12,14H,3,7H2,1-2H3