(3-fluoranyl-4-methoxy-phenyl)methyl 2-(4-nitrophenyl)sulfanylethanoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 2-(4-nitrophenyl)sulfanylethanoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 2-(4-nitrophenyl)sulfanylacetate CAS Name: 2-[(4-nitrophenyl)thio]acetic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 2-(4-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-nitrophenyl)thio]acetic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C16H14FNO5S MolecularWeight: 351.349463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])F

InChI

InChI=1S/C16H14FNO5S/c1-22-15-7-2-11(8-14(15)17)9-23-16(19)10-24-13-5-3-12(4-6-13)18(20)21/h2-8H,9-10H2,1H3