octyl 2-[5-fluoranyl-2-[2-(3-nitrophenyl)ethanethioylamino]phenoxy]ethanoate

Systemtic Name: octyl 2-[5-fluoranyl-2-[2-(3-nitrophenyl)ethanethioylamino]phenoxy]ethanoate Openeye Name: octyl 2-[5-fluoro-2-[[2-(3-nitrophenyl)ethanethioyl]amino]phenoxy]acetate CAS Name: 2-[5-fluoro-2-[[2-(3-nitrophenyl)-1-sulfanylideneethyl]amino]phenoxy]acetic acid octyl ester IUPAC Name: octyl 2-[5-fluoro-2-[[2-(3-nitrophenyl)ethanethioyl]amino]phenoxy]acetate Traditional Name: 2-[5-fluoro-2-[[2-(3-nitrophenyl)thioacetyl]amino]phenoxy]acetic acid octyl ester Formula: C24H29FN2O5S MolecularWeight: 476.560863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)COC1=C(C=CC(=C1)F)NC(=S)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCOC(=O)COC1=C(C=CC(=C1)F)NC(=S)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C24H29FN2O5S/c1-2-3-4-5-6-7-13-31-24(28)17-32-22-16-19(25)11-12-21(22)26-23(33)15-18-9-8-10-20(14-18)27(29)30/h8-12,14,16H,2-7,13,15,17H2,1H3,(H,26,33)