N-tert-butyl-4-[(4-fluorophenyl)methylamino]-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[(4-fluorophenyl)methylamino]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-[(4-fluorophenyl)methylamino]-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-[(4-fluorophenyl)methylamino]-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-[(4-fluorophenyl)methylamino]-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-[(4-fluorobenzyl)amino]-3-nitro-benzenesulfonamide Formula: C17H20FN3O4S MolecularWeight: 381.421803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H20FN3O4S/c1-17(2,3)20-26(24,25)14-8-9-15(16(10-14)21(22)23)19-11-12-4-6-13(18)7-5-12/h4-10,19-20H,11H2,1-3H3