2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl-(p-tolylsulfonyl)amino]-N-(3-nitrophenyl)acetamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)-tosyl-amino]-N-(3-nitrophenyl)acetamide Formula: C22H19ClFN3O5S MolecularWeight: 491.919763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=C(C=CC=C2Cl)F)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=C(C=CC=C2Cl)F)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H19ClFN3O5S/c1-15-8-10-18(11-9-15)33(31,32)26(13-19-20(23)6-3-7-21(19)24)14-22(28)25-16-4-2-5-17(12-16)27(29)30/h2-12H,13-14H2,1H3,(H,25,28)