ethyl 3-[2,4-bis(fluoranyl)phenyl]sulfanyl-4-nitro-benzoate

Systemtic Name: ethyl 3-[2,4-bis(fluoranyl)phenyl]sulfanyl-4-nitro-benzoate Openeye Name: ethyl 3-(2,4-difluorophenyl)sulfanyl-4-nitro-benzoate CAS Name: 3-[(2,4-difluorophenyl)thio]-4-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-(2,4-difluorophenyl)sulfanyl-4-nitrobenzoate Traditional Name: 3-[(2,4-difluorophenyl)thio]-4-nitro-benzoic acid ethyl ester Formula: C15H11F2NO4S MolecularWeight: 339.313946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])SC2=C(C=C(C=C2)F)F

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])SC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C15H11F2NO4S/c1-2-22-15(19)9-3-5-12(18(20)21)14(7-9)23-13-6-4-10(16)8-11(13)17/h3-8H,2H2,1H3