N-[1-(diethylamino)propan-2-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[1-(diethylamino)propan-2-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(diethylamino)-1-methyl-ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[1-(diethylamino)propan-2-yl]-4-nitrobenzenesulfonamide IUPAC Name: N-[1-(diethylamino)propan-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(diethylamino)-1-methyl-ethyl]-4-nitro-benzenesulfonamide Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O4S/c1-4-15(5-2)10-11(3)14-21(19,20)13-8-6-12(7-9-13)16(17)18/h6-9,11,14H,4-5,10H2,1-3H3