methyl 2-fluoranyl-5-[2-(4-nitrophenyl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 2-fluoranyl-5-[2-(4-nitrophenyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 2-fluoro-5-[[2-(4-nitrophenyl)sulfanylacetyl]amino]benzoate CAS Name: 2-fluoro-5-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-fluoro-5-[[2-(4-nitrophenyl)sulfanylacetyl]amino]benzoate Traditional Name: 2-fluoro-5-[[2-[(4-nitrophenyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C16H13FN2O5S MolecularWeight: 364.348223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13FN2O5S/c1-24-16(21)13-8-10(2-7-14(13)17)18-15(20)9-25-12-5-3-11(4-6-12)19(22)23/h2-8H,9H2,1H3,(H,18,20)