tert-butyl 2-carboniodidoyl-3-fluoranyl-4-[[2-(trifluoromethyl)phenyl]methylamino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 2-carboniodidoyl-3-fluoranyl-4-[[2-(trifluoromethyl)phenyl]methylamino]piperidine-1-carboxylate Openeye Name: tert-butyl 3-fluoro-2-iodocarbonyl-4-[[2-(trifluoromethyl)phenyl]methylamino]piperidine-1-carboxylate CAS Name: 2-carboniodidoyl-3-fluoro-4-[[2-(trifluoromethyl)phenyl]methylamino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-carboniodidoyl-3-fluoro-4-[[2-(trifluoromethyl)phenyl]methylamino]piperidine-1-carboxylate Traditional Name: 3-fluoro-2-iodocarbonyl-4-[[2-(trifluoromethyl)benzyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H23F4IN2O3 MolecularWeight: 530.295603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C(C1C(=O)I)F)NCC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C(C1C(=O)I)F)NCC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C19H23F4IN2O3/c1-18(2,3)29-17(28)26-9-8-13(14(20)15(26)16(24)27)25-10-11-6-4-5-7-12(11)19(21,22)23/h4-7,13-15,25H,8-10H2,1-3H3