(4-nitrophenyl)methyl 2-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: (4-nitrophenyl)methyl 2-[2-(2-fluoroanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(2-fluoroanilino)-2-oxoethyl]thio]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[2-(2-fluoroanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(2-fluoroanilino)-2-keto-ethyl]thio]acetic acid (4-nitrobenzyl) ester Formula: C17H15FN2O5S MolecularWeight: 378.374803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CSCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CSCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])F

InChI

InChI=1S/C17H15FN2O5S/c18-14-3-1-2-4-15(14)19-16(21)10-26-11-17(22)25-9-12-5-7-13(8-6-12)20(23)24/h1-8H,9-11H2,(H,19,21)