N,N-diethyl-3-nitro-4-(pyridin-3-ylmethylamino)benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-(pyridin-3-ylmethylamino)benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-(3-pyridylmethylamino)benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-(3-pyridinylmethylamino)benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-(pyridin-3-ylmethylamino)benzenesulfonamide Traditional Name: N,N-diethyl-3-nitro-4-(3-pyridylmethylamino)benzenesulfonamide Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=CN=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=CN=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O4S/c1-3-19(4-2)25(23,24)14-7-8-15(16(10-14)20(21)22)18-12-13-6-5-9-17-11-13/h5-11,18H,3-4,12H2,1-2H3