3-nitro-4-oxidanyl-N-pentan-3-yl-benzenesulfonamide

Systemtic Name: 3-nitro-4-oxidanyl-N-pentan-3-yl-benzenesulfonamide Openeye Name: N-(1-ethylpropyl)-4-hydroxy-3-nitro-benzenesulfonamide CAS Name: 4-hydroxy-3-nitro-N-pentan-3-ylbenzenesulfonamide IUPAC Name: 4-hydroxy-3-nitro-N-pentan-3-ylbenzenesulfonamide Traditional Name: N-(1-ethylpropyl)-4-hydroxy-3-nitro-benzenesulfonamide Formula: C11H16N2O5S MolecularWeight: 288.32014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O5S/c1-3-8(4-2)12-19(17,18)9-5-6-11(14)10(7-9)13(15)16/h5-8,12,14H,3-4H2,1-2H3