(2-nitrophenyl)methyl 3-(4-fluorophenyl)sulfonylpropanoate

Systemtic Name: (2-nitrophenyl)methyl 3-(4-fluorophenyl)sulfonylpropanoate Openeye Name: (2-nitrophenyl)methyl 3-(4-fluorophenyl)sulfonylpropanoate CAS Name: 3-(4-fluorophenyl)sulfonylpropanoic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 3-(4-fluorophenyl)sulfonylpropanoate Traditional Name: 3-(4-fluorophenyl)sulfonylpropionic acid (2-nitrobenzyl) ester Formula: C16H14FNO6S MolecularWeight: 367.348863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C16H14FNO6S/c17-13-5-7-14(8-6-13)25(22,23)10-9-16(19)24-11-12-3-1-2-4-15(12)18(20)21/h1-8H,9-11H2