2-chloranyl-N-[3-(diethylamino)propyl]-5-nitro-benzenesulfonamide

Systemtic Name: 2-chloranyl-N-[3-(diethylamino)propyl]-5-nitro-benzenesulfonamide Openeye Name: 2-chloro-N-[3-(diethylamino)propyl]-5-nitro-benzenesulfonamide CAS Name: 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-chloro-N-[3-(diethylamino)propyl]-5-nitrobenzenesulfonamide Traditional Name: 2-chloro-N-[3-(diethylamino)propyl]-5-nitro-benzenesulfonamide Formula: C13H20ClN3O4S MolecularWeight: 349.8336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20ClN3O4S/c1-3-16(4-2)9-5-8-15-22(20,21)13-10-11(17(18)19)6-7-12(13)14/h6-7,10,15H,3-5,8-9H2,1-2H3