methyl 4-(2-chloranyl-5-methoxy-phenoxy)-3-[2-(oxan-2-yloxy)ethoxy]-5-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoate

Systemtic Name: methyl 4-(2-chloranyl-5-methoxy-phenoxy)-3-[2-(oxan-2-yloxy)ethoxy]-5-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoate Openeye Name: methyl 4-(2-chloro-5-methoxy-phenoxy)-3-(2-tetrahydropyran-2-yloxyethoxy)-5-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoate CAS Name: 4-(2-chloro-5-methoxyphenoxy)-3-[2-(2-oxanyloxy)ethoxy]-5-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 4-(2-chloro-5-methoxyphenoxy)-3-[2-(oxan-2-yloxy)ethoxy]-5-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoate Traditional Name: 4-(2-chloro-5-methoxy-phenoxy)-3-(2-tetrahydropyran-2-yloxyethoxy)-5-[[4-(trifluoromethyl)phenyl]sulfonylamino]benzoic acid methyl ester Formula: C29H29ClF3NO9S MolecularWeight: 660.05507

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Cl)OC2=C(C=C(C=C2OCCOC3CCCCO3)C(=O)OC)NS(=O)(=O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

COC1=CC(=C(C=C1)Cl)OC2=C(C=C(C=C2OCCOC3CCCCO3)C(=O)OC)NS(=O)(=O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C29H29ClF3NO9S/c1-38-20-8-11-22(30)24(17-20)43-27-23(34-44(36,37)21-9-6-19(7-10-21)29(31,32)33)15-18(28(35)39-2)16-25(27)40-13-14-42-26-5-3-4-12-41-26/h6-11,15-17,26,34H,3-5,12-14H2,1-2H3