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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

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