[4-(trifluoromethyl)phenyl]methyl 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate

Systemtic Name: [4-(trifluoromethyl)phenyl]methyl 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Openeye Name: [4-(trifluoromethyl)phenyl]methyl 2-methyl-1-methylsulfonyl-indoline-5-carboxylate CAS Name: 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid [4-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [4-(trifluoromethyl)phenyl]methyl 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Traditional Name: 1-mesyl-2-methyl-indoline-5-carboxylic acid [4-(trifluoromethyl)benzyl] ester Formula: C19H18F3NO4S MolecularWeight: 413.41073

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)OCC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)OCC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H18F3NO4S/c1-12-9-15-10-14(5-8-17(15)23(12)28(2,25)26)18(24)27-11-13-3-6-16(7-4-13)19(20,21)22/h3-8,10,12H,9,11H2,1-2H3