tert-butyl 5-(trifluoromethyl)-1,4-diazepane-1-carboxylate

Systemtic Name: tert-butyl 5-(trifluoromethyl)-1,4-diazepane-1-carboxylate Openeye Name: tert-butyl 5-(trifluoromethyl)-1,4-diazepane-1-carboxylate CAS Name: 5-(trifluoromethyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(trifluoromethyl)-1,4-diazepane-1-carboxylate Traditional Name: 5-(trifluoromethyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester Formula: C11H19F3N2O2 MolecularWeight: 268.27597

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(NCC1)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(NCC1)C(F)(F)F

InChI

InChI=1S/C11H19F3N2O2/c1-10(2,3)18-9(17)16-6-4-8(11(12,13)14)15-5-7-16/h8,15H,4-7H2,1-3H3