2-methoxyethoxymethyl 2-[2-methoxycarbonyl-4-(2-methylpropylcarbamoyl)phenyl]-6-(trifluoromethylsulfonyloxy)benzoate

Systemtic Name: 2-methoxyethoxymethyl 2-[2-methoxycarbonyl-4-(2-methylpropylcarbamoyl)phenyl]-6-(trifluoromethylsulfonyloxy)benzoate Openeye Name: 2-methoxyethoxymethyl 2-[4-(isobutylcarbamoyl)-2-methoxycarbonyl-phenyl]-6-(trifluoromethylsulfonyloxy)benzoate CAS Name: 2-[2-methoxycarbonyl-4-[(2-methylpropylamino)-oxomethyl]phenyl]-6-(trifluoromethylsulfonyloxy)benzoic acid 2-methoxyethoxymethyl ester IUPAC Name: 2-methoxyethoxymethyl 2-[2-methoxycarbonyl-4-(2-methylpropylcarbamoyl)phenyl]-6-(trifluoromethylsulfonyloxy)benzoate Traditional Name: 2-[2-carbomethoxy-4-(isobutylcarbamoyl)phenyl]-6-triflyloxy-benzoic acid 2-methoxyethoxymethyl ester Formula: C25H28F3NO10S MolecularWeight: 591.55073

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C(=CC=C2)OS(=O)(=O)C(F)(F)F)C(=O)OCOCCOC)C(=O)OC

Isomeric SMILES

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C(=CC=C2)OS(=O)(=O)C(F)(F)F)C(=O)OCOCCOC)C(=O)OC

InChI

InChI=1S/C25H28F3NO10S/c1-15(2)13-29-22(30)16-8-9-17(19(12-16)23(31)36-4)18-6-5-7-20(39-40(33,34)25(26,27)28)21(18)24(32)38-14-37-11-10-35-3/h5-9,12,15H,10-11,13-14H2,1-4H3,(H,29,30)