4-chloranyl-N-[3-(2-methylpropoxy)propyl]-2-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[3-(2-methylpropoxy)propyl]-2-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(3-isobutoxypropyl)-2-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[3-(2-methylpropoxy)propyl]-2-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[3-(2-methylpropoxy)propyl]-2-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(3-isobutoxypropyl)-2-nitro-benzenesulfonamide Formula: C13H19ClN2O5S MolecularWeight: 350.81836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19ClN2O5S/c1-10(2)9-21-7-3-6-15-22(19,20)13-5-4-11(14)8-12(13)16(17)18/h4-5,8,10,15H,3,6-7,9H2,1-2H3