2-(3-fluorophenyl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide

Systemtic Name: 2-(3-fluorophenyl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide Openeye Name: 2-(3-fluorophenyl)-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]acetamide CAS Name: 2-(3-fluorophenyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide IUPAC Name: 2-(3-fluorophenyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide Traditional Name: 2-(3-fluorophenyl)-N-[2-(4-mesyl-2-nitro-anilino)ethyl]acetamide Formula: C17H18FN3O5S MolecularWeight: 395.405323

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CC2=CC(=CC=C2)F)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CC2=CC(=CC=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H18FN3O5S/c1-27(25,26)14-5-6-15(16(11-14)21(23)24)19-7-8-20-17(22)10-12-3-2-4-13(18)9-12/h2-6,9,11,19H,7-8,10H2,1H3,(H,20,22)