tert-butyl 3-[2-azanyl-1,1-bis(fluoranyl)ethyl]-5-oxidanyl-indole-1-carboxylate

Systemtic Name: tert-butyl 3-[2-azanyl-1,1-bis(fluoranyl)ethyl]-5-oxidanyl-indole-1-carboxylate Openeye Name: tert-butyl 3-(2-amino-1,1-difluoro-ethyl)-5-hydroxy-indole-1-carboxylate CAS Name: 3-(2-amino-1,1-difluoroethyl)-5-hydroxy-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-amino-1,1-difluoroethyl)-5-hydroxyindole-1-carboxylate Traditional Name: 3-(2-amino-1,1-difluoro-ethyl)-5-hydroxy-indole-1-carboxylic acid tert-butyl ester Formula: C15H18F2N2O3 MolecularWeight: 312.311826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)O)C(CN)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)O)C(CN)(F)F

InChI

InChI=1S/C15H18F2N2O3/c1-14(2,3)22-13(21)19-7-11(15(16,17)8-18)10-6-9(20)4-5-12(10)19/h4-7,20H,8,18H2,1-3H3