2-acetamido-N-(2-fluoranyl-5-nitro-phenyl)-4-methylsulfonyl-butanamide

Systemtic Name: 2-acetamido-N-(2-fluoranyl-5-nitro-phenyl)-4-methylsulfonyl-butanamide Openeye Name: 2-acetamido-N-(2-fluoro-5-nitro-phenyl)-4-methylsulfonyl-butanamide CAS Name: 2-acetamido-N-(2-fluoro-5-nitrophenyl)-4-methylsulfonylbutanamide IUPAC Name: 2-acetamido-N-(2-fluoro-5-nitrophenyl)-4-methylsulfonylbutanamide Traditional Name: 2-acetamido-N-(2-fluoro-5-nitro-phenyl)-4-mesyl-butyramide Formula: C13H16FN3O6S MolecularWeight: 361.346043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCS(=O)(=O)C)C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])F

Isomeric SMILES

CC(=O)NC(CCS(=O)(=O)C)C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])F

InChI

InChI=1S/C13H16FN3O6S/c1-8(18)15-11(5-6-24(2,22)23)13(19)16-12-7-9(17(20)21)3-4-10(12)14/h3-4,7,11H,5-6H2,1-2H3,(H,15,18)(H,16,19)