N-(2-chloranyl-5-nitro-phenyl)-2-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(4-fluoro-N-methylsulfonyl-anilino)butanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-(4-fluoro-N-methylsulfonylanilino)butanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(4-fluoro-N-methylsulfonylanilino)butanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-(4-fluoro-N-mesyl-anilino)butyramide Formula: C17H17ClFN3O5S MolecularWeight: 429.850383

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)N(C2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)N(C2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C17H17ClFN3O5S/c1-3-16(21(28(2,26)27)12-6-4-11(19)5-7-12)17(23)20-15-10-13(22(24)25)8-9-14(15)18/h4-10,16H,3H2,1-2H3,(H,20,23)