4-[[1-(dimethylamino)cyclohexyl]methylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[[1-(dimethylamino)cyclohexyl]methylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[[1-(dimethylamino)cyclohexyl]methylamino]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[[1-(dimethylamino)cyclohexyl]methylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[[1-(dimethylamino)cyclohexyl]methylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[[1-(dimethylamino)cyclohexyl]methylamino]-N-isopropyl-3-nitro-benzenesulfonamide Formula: C18H30N4O4S MolecularWeight: 398.5202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC2(CCCCC2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC2(CCCCC2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H30N4O4S/c1-14(2)20-27(25,26)15-8-9-16(17(12-15)22(23)24)19-13-18(21(3)4)10-6-5-7-11-18/h8-9,12,14,19-20H,5-7,10-11,13H2,1-4H3