3-bromanyl-4-(cyclohexylmethylamino)-5-nitro-benzenesulfonamide

Systemtic Name: 3-bromanyl-4-(cyclohexylmethylamino)-5-nitro-benzenesulfonamide Openeye Name: 3-bromo-4-(cyclohexylmethylamino)-5-nitro-benzenesulfonamide CAS Name: 3-bromo-4-(cyclohexylmethylamino)-5-nitrobenzenesulfonamide IUPAC Name: 3-bromo-4-(cyclohexylmethylamino)-5-nitrobenzenesulfonamide Traditional Name: 3-bromo-4-(cyclohexylmethylamino)-5-nitro-benzenesulfonamide Formula: C13H18BrN3O4S MolecularWeight: 392.26872

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC2=C(C=C(C=C2[N+](=O)[O-])S(=O)(=O)N)Br

Isomeric SMILES

C1CCC(CC1)CNC2=C(C=C(C=C2[N+](=O)[O-])S(=O)(=O)N)Br

InChI

InChI=1S/C13H18BrN3O4S/c14-11-6-10(22(15,20)21)7-12(17(18)19)13(11)16-8-9-4-2-1-3-5-9/h6-7,9,16H,1-5,8H2,(H2,15,20,21)