N,3-dinitro-2,4,5-tripropyl-N-propylsulfanyl-benzenesulfonamide

Systemtic Name: N,3-dinitro-2,4,5-tripropyl-N-propylsulfanyl-benzenesulfonamide Openeye Name: N,3-dinitro-2,4,5-tripropyl-N-propylsulfanyl-benzenesulfonamide CAS Name: N,3-dinitro-2,4,5-tripropyl-N-(propylthio)benzenesulfonamide IUPAC Name: N,3-dinitro-2,4,5-tripropyl-N-propylsulfanylbenzenesulfonamide Traditional Name: N,3-dinitro-2,4,5-tripropyl-N-(propylthio)benzenesulfonamide Formula: C18H29N3O6S2 MolecularWeight: 447.56936

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1CCC)[N+](=O)[O-])CCC)S(=O)(=O)N([N+](=O)[O-])SCCC

Isomeric SMILES

CCCC1=CC(=C(C(=C1CCC)[N+](=O)[O-])CCC)S(=O)(=O)N([N+](=O)[O-])SCCC

InChI

InChI=1S/C18H29N3O6S2/c1-5-9-14-13-17(29(26,27)21(20(24)25)28-12-8-4)16(11-7-3)18(19(22)23)15(14)10-6-2/h13H,5-12H2,1-4H3