tert-butyl 3-[1-phenylmethoxycarbonyl-4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridin-6-yl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[1-phenylmethoxycarbonyl-4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridin-6-yl]indole-1-carboxylate Openeye Name: tert-butyl 3-[1-benzyloxycarbonyl-4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridin-6-yl]indole-1-carboxylate CAS Name: 3-[1-phenylmethoxycarbonyl-4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridin-6-yl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[1-phenylmethoxycarbonyl-4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridin-6-yl]indole-1-carboxylate Traditional Name: 3-(1-carbobenzoxy-4-triflyloxy-3,6-dihydro-2H-pyridin-6-yl)indole-1-carboxylic acid tert-butyl ester Formula: C27H27F3N2O7S MolecularWeight: 580.57269

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3C=C(CCN3C(=O)OCC4=CC=CC=C4)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3C=C(CCN3C(=O)OCC4=CC=CC=C4)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C27H27F3N2O7S/c1-26(2,3)38-25(34)32-16-21(20-11-7-8-12-22(20)32)23-15-19(39-40(35,36)27(28,29)30)13-14-31(23)24(33)37-17-18-9-5-4-6-10-18/h4-12,15-16,23H,13-14,17H2,1-3H3