13-oxidanylidene-13-[[3-(4-oxidanyl-4-oxidanylidene-butoxy)-5-(trifluoromethyl)thiophen-2-yl]amino]tridecanoic acid

Systemtic Name: 13-oxidanylidene-13-[[3-(4-oxidanyl-4-oxidanylidene-butoxy)-5-(trifluoromethyl)thiophen-2-yl]amino]tridecanoic acid Openeye Name: 13-[[3-(4-hydroxy-4-oxo-butoxy)-5-(trifluoromethyl)-2-thienyl]amino]-13-oxo-tridecanoic acid CAS Name: 13-[[3-(4-hydroxy-4-oxobutoxy)-5-(trifluoromethyl)-2-thiophenyl]amino]-13-oxotridecanoic acid IUPAC Name: 13-[[3-(4-hydroxy-4-oxobutoxy)-5-(trifluoromethyl)thiophen-2-yl]amino]-13-oxotridecanoic acid Traditional Name: 13-[[3-(4-hydroxy-4-keto-butoxy)-5-(trifluoromethyl)-2-thienyl]amino]-13-keto-tridecanoic acid Formula: C22H32F3NO6S MolecularWeight: 495.55279

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1OCCCC(=O)O)NC(=O)CCCCCCCCCCCC(=O)O)C(F)(F)F

Isomeric SMILES

C1=C(SC(=C1OCCCC(=O)O)NC(=O)CCCCCCCCCCCC(=O)O)C(F)(F)F

InChI

InChI=1S/C22H32F3NO6S/c23-22(24,25)17-15-16(32-14-10-13-20(30)31)21(33-17)26-18(27)11-8-6-4-2-1-3-5-7-9-12-19(28)29/h15H,1-14H2,(H,26,27)(H,28,29)(H,30,31)