2-(2-fluorophenyl)sulfanylethyl 2-[(4-methoxy-3-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: 2-(2-fluorophenyl)sulfanylethyl 2-[(4-methoxy-3-nitro-phenyl)carbonylamino]ethanoate Openeye Name: 2-(2-fluorophenyl)sulfanylethyl 2-[(4-methoxy-3-nitro-benzoyl)amino]acetate CAS Name: 2-[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]acetic acid 2-[(2-fluorophenyl)thio]ethyl ester IUPAC Name: 2-(2-fluorophenyl)sulfanylethyl 2-[(4-methoxy-3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(4-methoxy-3-nitro-benzoyl)amino]acetic acid 2-[(2-fluorophenyl)thio]ethyl ester Formula: C18H17FN2O6S MolecularWeight: 408.400783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCCSC2=CC=CC=C2F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCCSC2=CC=CC=C2F)[N+](=O)[O-]

InChI

InChI=1S/C18H17FN2O6S/c1-26-15-7-6-12(10-14(15)21(24)25)18(23)20-11-17(22)27-8-9-28-16-5-3-2-4-13(16)19/h2-7,10H,8-9,11H2,1H3,(H,20,23)