4,5-dimethyl-2-nitro-N-(2-oxidanylpropyl)benzenesulfonamide

Systemtic Name: 4,5-dimethyl-2-nitro-N-(2-oxidanylpropyl)benzenesulfonamide Openeye Name: N-(2-hydroxypropyl)-4,5-dimethyl-2-nitro-benzenesulfonamide CAS Name: N-(2-hydroxypropyl)-4,5-dimethyl-2-nitrobenzenesulfonamide IUPAC Name: N-(2-hydroxypropyl)-4,5-dimethyl-2-nitrobenzenesulfonamide Traditional Name: N-(2-hydroxypropyl)-4,5-dimethyl-2-nitro-benzenesulfonamide Formula: C11H16N2O5S MolecularWeight: 288.32014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)NCC(C)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)NCC(C)O)[N+](=O)[O-]

InChI

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