(2-chloranyl-6-fluoranyl-phenyl)methyl 2-[(4-methyl-2-nitro-phenyl)sulfonylamino]ethanoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 2-[(4-methyl-2-nitro-phenyl)sulfonylamino]ethanoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 2-[(4-methyl-2-nitro-phenyl)sulfonylamino]acetate CAS Name: 2-[(4-methyl-2-nitrophenyl)sulfonylamino]acetic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 2-[(4-methyl-2-nitrophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-methyl-2-nitro-phenyl)sulfonylamino]acetic acid (2-chloro-6-fluoro-benzyl) ester Formula: C16H14ClFN2O6S MolecularWeight: 416.808563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NCC(=O)OCC2=C(C=CC=C2Cl)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NCC(=O)OCC2=C(C=CC=C2Cl)F)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClFN2O6S/c1-10-5-6-15(14(7-10)20(22)23)27(24,25)19-8-16(21)26-9-11-12(17)3-2-4-13(11)18/h2-7,19H,8-9H2,1H3