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

Systemtic Name: tert-butyl 3-[2-azido-1,1-bis(fluoranyl)ethyl]indole-1-carboxylate Openeye Name: tert-butyl 3-(2-azido-1,1-difluoro-ethyl)indole-1-carboxylate CAS Name: 3-(2-azido-1,1-difluoroethyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-azido-1,1-difluoroethyl)indole-1-carboxylate Traditional Name: 3-(2-azido-1,1-difluoro-ethyl)indole-1-carboxylic acid tert-butyl ester Formula: C15H16F2N4O2 MolecularWeight: 322.309946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C(CN=[N+]=[N-])(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C(CN=[N+]=[N-])(F)F

InChI

InChI=1S/C15H16F2N4O2/c1-14(2,3)23-13(22)21-8-11(15(16,17)9-19-20-18)10-6-4-5-7-12(10)21/h4-8H,9H2,1-3H3