[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 4-[bis(fluoranyl)methylsulfonyl]benzoate

Systemtic Name: [2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 4-[bis(fluoranyl)methylsulfonyl]benzoate Openeye Name: [2-(ethoxycarbonylamino)-2-oxo-ethyl] 4-(difluoromethylsulfonyl)benzoate CAS Name: 4-(difluoromethylsulfonyl)benzoic acid [2-(ethoxycarbonylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethoxycarbonylamino)-2-oxoethyl] 4-(difluoromethylsulfonyl)benzoate Traditional Name: 4-(difluoromethylsulfonyl)benzoic acid [2-(carbethoxyamino)-2-keto-ethyl] ester Formula: C13H13F2NO7S MolecularWeight: 365.306626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)S(=O)(=O)C(F)F

Isomeric SMILES

CCOC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)S(=O)(=O)C(F)F

InChI

InChI=1S/C13H13F2NO7S/c1-2-22-13(19)16-10(17)7-23-11(18)8-3-5-9(6-4-8)24(20,21)12(14)15/h3-6,12H,2,7H2,1H3,(H,16,17,19)