2-chloranyl-N-ethyl-N-(2-methylpropyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-chloranyl-N-ethyl-N-(2-methylpropyl)-5-nitro-benzenesulfonamide Openeye Name: 2-chloro-N-ethyl-N-isobutyl-5-nitro-benzenesulfonamide CAS Name: 2-chloro-N-ethyl-N-(2-methylpropyl)-5-nitrobenzenesulfonamide IUPAC Name: 2-chloro-N-ethyl-N-(2-methylpropyl)-5-nitrobenzenesulfonamide Traditional Name: 2-chloro-N-ethyl-N-isobutyl-5-nitro-benzenesulfonamide Formula: C12H17ClN2O4S MolecularWeight: 320.79238

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(C)C)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CCN(CC(C)C)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H17ClN2O4S/c1-4-14(8-9(2)3)20(18,19)12-7-10(15(16)17)5-6-11(12)13/h5-7,9H,4,8H2,1-3H3