5-[3-[(4S)-4-[(3R)-4,4-bis(fluoranyl)-3-oxidanyl-4-[3-(trifluoromethyl)phenyl]butyl]-2-oxidanylidene-1,3-oxazinan-3-yl]propyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-[(4S)-4-[(3R)-4,4-bis(fluoranyl)-3-oxidanyl-4-[3-(trifluoromethyl)phenyl]butyl]-2-oxidanylidene-1,3-oxazinan-3-yl]propyl]thiophene-2-carboxylic acid Openeye Name: 5-[3-[(4S)-4-[(3R)-4,4-difluoro-3-hydroxy-4-[3-(trifluoromethyl)phenyl]butyl]-2-oxo-1,3-oxazinan-3-yl]propyl]thiophene-2-carboxylic acid CAS Name: 5-[3-[(4S)-4-[(3R)-4,4-difluoro-3-hydroxy-4-[3-(trifluoromethyl)phenyl]butyl]-2-oxo-1,3-oxazinan-3-yl]propyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-[(4S)-4-[(3R)-4,4-difluoro-3-hydroxy-4-[3-(trifluoromethyl)phenyl]butyl]-2-oxo-1,3-oxazinan-3-yl]propyl]thiophene-2-carboxylic acid Traditional Name: 5-[3-[(4S)-4-[(3R)-4,4-difluoro-3-hydroxy-4-[3-(trifluoromethyl)phenyl]butyl]-2-keto-1,3-oxazinan-3-yl]propyl]-2-thenoic acid Formula: C23H24F5NO5S MolecularWeight: 521.497376

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)N(C1CCC(C(C2=CC(=CC=C2)C(F)(F)F)(F)F)O)CCCC3=CC=C(S3)C(=O)O

Isomeric SMILES

C1COC(=O)N([C@H]1CC[C@H](C(C2=CC(=CC=C2)C(F)(F)F)(F)F)O)CCCC3=CC=C(S3)C(=O)O

InChI

InChI=1S/C23H24F5NO5S/c24-22(25,14-3-1-4-15(13-14)23(26,27)28)19(30)9-6-16-10-12-34-21(33)29(16)11-2-5-17-7-8-18(35-17)20(31)32/h1,3-4,7-8,13,16,19,30H,2,5-6,9-12H2,(H,31,32)/t16-,19+/m0/s1