[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-[bis(fluoranyl)methylsulfonyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-[bis(fluoranyl)methylsulfonyl]benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 4-(difluoromethylsulfonyl)benzoate CAS Name: 4-(difluoromethylsulfonyl)benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 4-(difluoromethylsulfonyl)benzoate Traditional Name: 4-(difluoromethylsulfonyl)benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C15H19F2NO5S MolecularWeight: 363.376866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19F2NO5S/c1-3-11(4-2)18-13(19)9-23-14(20)10-5-7-12(8-6-10)24(21,22)15(16)17/h5-8,11,15H,3-4,9H2,1-2H3,(H,18,19)