N-[(1S)-1-(4-fluorophenyl)ethyl]-N-methyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide

Systemtic Name: N-[(1S)-1-(4-fluorophenyl)ethyl]-N-methyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide Openeye Name: N-[(1S)-1-(4-fluorophenyl)ethyl]-N-methyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetamide CAS Name: N-[(1S)-1-(4-fluorophenyl)ethyl]-N-methyl-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide IUPAC Name: N-[(1S)-1-(4-fluorophenyl)ethyl]-N-methyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)acetamide Traditional Name: N-[(1S)-1-(4-fluorophenyl)ethyl]-N-methyl-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)acetamide Formula: C21H24FN3O6S MolecularWeight: 465.495163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)N(C)C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)F)N(C)C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H24FN3O6S/c1-15(16-5-7-17(22)8-6-16)23(2)21(26)14-31-20-10-9-18(13-19(20)25(27)28)32(29,30)24-11-3-4-12-24/h5-10,13,15H,3-4,11-12,14H2,1-2H3/t15-/m0/s1