N-[(4-fluorophenyl)methyl]-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-nitro-anilino]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-(N-besyl-3-nitro-anilino)-N-(4-fluorobenzyl)acetamide Formula: C21H18FN3O5S MolecularWeight: 443.448123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=C(C=C2)F)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=C(C=C2)F)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18FN3O5S/c22-17-11-9-16(10-12-17)14-23-21(26)15-24(18-5-4-6-19(13-18)25(27)28)31(29,30)20-7-2-1-3-8-20/h1-13H,14-15H2,(H,23,26)