4-[2-(cyclohexen-1-yl)ethylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[2-(cyclohexen-1-yl)ethylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[2-(cyclohexen-1-yl)ethylamino]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[2-(1-cyclohexenyl)ethylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[2-(cyclohexen-1-yl)ethylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[2-(cyclohexen-1-yl)ethylamino]-N-isopropyl-3-nitro-benzenesulfonamide Formula: C17H25N3O4S MolecularWeight: 367.4631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O4S/c1-13(2)19-25(23,24)15-8-9-16(17(12-15)20(21)22)18-11-10-14-6-4-3-5-7-14/h6,8-9,12-13,18-19H,3-5,7,10-11H2,1-2H3