(4-aminocarbonylphenyl)methyl 2-[bis(fluoranyl)methylsulfanyl]benzoate

Systemtic Name: (4-aminocarbonylphenyl)methyl 2-[bis(fluoranyl)methylsulfanyl]benzoate Openeye Name: (4-carbamoylphenyl)methyl 2-(difluoromethylsulfanyl)benzoate CAS Name: 2-(difluoromethylthio)benzoic acid (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)methyl 2-(difluoromethylsulfanyl)benzoate Traditional Name: 2-(difluoromethylthio)benzoic acid (4-carbamoylbenzyl) ester Formula: C16H13F2NO3S MolecularWeight: 337.341126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC2=CC=C(C=C2)C(=O)N)SC(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC2=CC=C(C=C2)C(=O)N)SC(F)F

InChI

InChI=1S/C16H13F2NO3S/c17-16(18)23-13-4-2-1-3-12(13)15(21)22-9-10-5-7-11(8-6-10)14(19)20/h1-8,16H,9H2,(H2,19,20)