4-[1-[3,4-bis(fluoranyl)phenyl]ethylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[1-[3,4-bis(fluoranyl)phenyl]ethylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[1-(3,4-difluorophenyl)ethylamino]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[1-(3,4-difluorophenyl)ethylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[1-(3,4-difluorophenyl)ethylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[1-(3,4-difluorophenyl)ethylamino]-N-isopropyl-3-nitro-benzenesulfonamide Formula: C17H19F2N3O4S MolecularWeight: 399.412266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19F2N3O4S/c1-10(2)21-27(25,26)13-5-7-16(17(9-13)22(23)24)20-11(3)12-4-6-14(18)15(19)8-12/h4-11,20-21H,1-3H3