(phenylmethyl) 5-(2-methylsulfonyloxyethyl)-2-(trifluoromethyl)-1H-indole-3-carboxylate

Systemtic Name: (phenylmethyl) 5-(2-methylsulfonyloxyethyl)-2-(trifluoromethyl)-1H-indole-3-carboxylate Openeye Name: benzyl 5-(2-methylsulfonyloxyethyl)-2-(trifluoromethyl)-1H-indole-3-carboxylate CAS Name: 5-(2-methylsulfonyloxyethyl)-2-(trifluoromethyl)-1H-indole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(2-methylsulfonyloxyethyl)-2-(trifluoromethyl)-1H-indole-3-carboxylate Traditional Name: 5-(2-methylsulfonyloxyethyl)-2-(trifluoromethyl)-1H-indole-3-carboxylic acid benzyl ester Formula: C20H18F3NO5S MolecularWeight: 441.42083

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC1=CC2=C(C=C1)NC(=C2C(=O)OCC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)OCCC1=CC2=C(C=C1)NC(=C2C(=O)OCC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H18F3NO5S/c1-30(26,27)29-10-9-13-7-8-16-15(11-13)17(18(24-16)20(21,22)23)19(25)28-12-14-5-3-2-4-6-14/h2-8,11,24H,9-10,12H2,1H3