3-[4-[bis(fluoranyl)methoxy]-3-cyclopropyloxy-phenyl]-3-[2-[1,1,1,3,3,3-hexakis(fluoranyl)-2-(2-trimethylsilylethoxymethoxy)propan-2-yl]-1,3-thiazol-5-yl]-2-(1-oxidanidylpyridin-1-ium-3-yl)propanoic acid

Systemtic Name: 3-[4-[bis(fluoranyl)methoxy]-3-cyclopropyloxy-phenyl]-3-[2-[1,1,1,3,3,3-hexakis(fluoranyl)-2-(2-trimethylsilylethoxymethoxy)propan-2-yl]-1,3-thiazol-5-yl]-2-(1-oxidanidylpyridin-1-ium-3-yl)propanoic acid Openeye Name: 3-[3-(cyclopropoxy)-4-(difluoromethoxy)phenyl]-2-(1-oxidopyridin-1-ium-3-yl)-3-[2-[2,2,2-trifluoro-1-(trifluoromethyl)-1-(2-trimethylsilylethoxymethoxy)ethyl]thiazol-5-yl]propanoic acid CAS Name: 3-[3-cyclopropyloxy-4-(difluoromethoxy)phenyl]-3-[2-[1,1,1,3,3,3-hexafluoro-2-(2-trimethylsilylethoxymethoxy)propan-2-yl]-5-thiazolyl]-2-(1-oxido-3-pyridin-1-iumyl)propanoic acid IUPAC Name: 3-[3-cyclopropyloxy-4-(difluoromethoxy)phenyl]-3-[2-[1,1,1,3,3,3-hexafluoro-2-(2-trimethylsilylethoxymethoxy)propan-2-yl]-1,3-thiazol-5-yl]-2-(1-oxidopyridin-1-ium-3-yl)propanoic acid Traditional Name: 3-[3-(cyclopropoxy)-4-(difluoromethoxy)phenyl]-2-(1-oxidopyridin-1-ium-3-yl)-3-[2-[2,2,2-trifluoro-1-(trifluoromethyl)-1-(2-trimethylsilylethoxymethoxy)ethyl]thiazol-5-yl]propionic acid Formula: C30H32F8N2O7SSi MolecularWeight: 744.722006

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Descriptors Computed from Structure

Canonical SMILES:

C[Si](C)(C)CCOCOC(C1=NC=C(S1)C(C2=CC(=C(C=C2)OC(F)F)OC3CC3)C(C4=C[N+](=CC=C4)[O-])C(=O)O)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

C[Si](C)(C)CCOCOC(C1=NC=C(S1)C(C2=CC(=C(C=C2)OC(F)F)OC3CC3)C(C4=C[N+](=CC=C4)[O-])C(=O)O)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C30H32F8N2O7SSi/c1-49(2,3)12-11-44-16-45-28(29(33,34)35,30(36,37)38)26-39-14-22(48-26)23(24(25(41)42)18-5-4-10-40(43)15-18)17-6-9-20(47-27(31)32)21(13-17)46-19-7-8-19/h4-6,9-10,13-15,19,23-24,27H,7-8,11-12,16H2,1-3H3,(H,41,42)