ethyl 2-[5-fluoranyl-2-[(3-nitrophenyl)methylcarbamothioyl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[5-fluoranyl-2-[(3-nitrophenyl)methylcarbamothioyl]phenoxy]ethanoate Openeye Name: ethyl 2-[5-fluoro-2-[(3-nitrophenyl)methylcarbamothioyl]phenoxy]acetate CAS Name: 2-[5-fluoro-2-[[(3-nitrophenyl)methylamino]-sulfanylidenemethyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-fluoro-2-[(3-nitrophenyl)methylcarbamothioyl]phenoxy]acetate Traditional Name: 2-[5-fluoro-2-[(3-nitrobenzyl)thiocarbamoyl]phenoxy]acetic acid ethyl ester Formula: C18H17FN2O5S MolecularWeight: 392.401383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=CC(=C1)F)C(=S)NCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)COC1=C(C=CC(=C1)F)C(=S)NCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17FN2O5S/c1-2-25-17(22)11-26-16-9-13(19)6-7-15(16)18(27)20-10-12-4-3-5-14(8-12)21(23)24/h3-9H,2,10-11H2,1H3,(H,20,27)