1-[4-[[(4-fluoranyl-2-nitro-phenyl)amino]methyl]phenyl]-N-propan-2-yl-methanesulfonamide

Systemtic Name: 1-[4-[[(4-fluoranyl-2-nitro-phenyl)amino]methyl]phenyl]-N-propan-2-yl-methanesulfonamide Openeye Name: 1-[4-[(4-fluoro-2-nitro-anilino)methyl]phenyl]-N-isopropyl-methanesulfonamide CAS Name: 1-[4-[(4-fluoro-2-nitroanilino)methyl]phenyl]-N-propan-2-ylmethanesulfonamide IUPAC Name: 1-[4-[(4-fluoro-2-nitroanilino)methyl]phenyl]-N-propan-2-ylmethanesulfonamide Traditional Name: 1-[4-[(4-fluoro-2-nitro-anilino)methyl]phenyl]-N-isopropyl-methanesulfonamide Formula: C17H20FN3O4S MolecularWeight: 381.421803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)CC1=CC=C(C=C1)CNC2=C(C=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)CC1=CC=C(C=C1)CNC2=C(C=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H20FN3O4S/c1-12(2)20-26(24,25)11-14-5-3-13(4-6-14)10-19-16-8-7-15(18)9-17(16)21(22)23/h3-9,12,19-20H,10-11H2,1-2H3