4-[[2-(diethylaminomethyl)phenyl]methylamino]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[2-(diethylaminomethyl)phenyl]methylamino]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[[2-(diethylaminomethyl)phenyl]methylamino]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[[2-(diethylaminomethyl)phenyl]methylamino]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[[2-(diethylaminomethyl)phenyl]methylamino]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[[2-(diethylaminomethyl)benzyl]amino]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C22H32N4O4S MolecularWeight: 448.57888

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=CC=C1CNC2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CC1=CC=CC=C1CNC2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)[N+](=O)[O-]

InChI

InChI=1S/C22H32N4O4S/c1-5-24(6-2)17-19-12-10-9-11-18(19)16-23-21-14-13-20(15-22(21)26(27)28)31(29,30)25(7-3)8-4/h9-15,23H,5-8,16-17H2,1-4H3