butyl 4-[[1,1-bis(oxidanylidene)thiolan-3-yl]-[2,2,2-tris(fluoranyl)ethanoyl]amino]benzoate

Systemtic Name: butyl 4-[[1,1-bis(oxidanylidene)thiolan-3-yl]-[2,2,2-tris(fluoranyl)ethanoyl]amino]benzoate Openeye Name: butyl 4-[(1,1-dioxothiolan-3-yl)-(2,2,2-trifluoroacetyl)amino]benzoate CAS Name: 4-[(1,1-dioxo-3-thiolanyl)-(2,2,2-trifluoro-1-oxoethyl)amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(1,1-dioxothiolan-3-yl)-(2,2,2-trifluoroacetyl)amino]benzoate Traditional Name: 4-[(1,1-diketothiolan-3-yl)-(2,2,2-trifluoroacetyl)amino]benzoic acid butyl ester Formula: C17H20F3NO5S MolecularWeight: 407.40461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)N(C2CCS(=O)(=O)C2)C(=O)C(F)(F)F

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N(C2CCS(=O)(=O)C2)C(=O)C(F)(F)F

InChI

InChI=1S/C17H20F3NO5S/c1-2-3-9-26-15(22)12-4-6-13(7-5-12)21(16(23)17(18,19)20)14-8-10-27(24,25)11-14/h4-7,14H,2-3,8-11H2,1H3