tert-butyl 4-(2-fluoranylethyl)-1,4-diazepane-1-carboxylate

Systemtic Name: tert-butyl 4-(2-fluoranylethyl)-1,4-diazepane-1-carboxylate Openeye Name: tert-butyl 4-(2-fluoroethyl)-1,4-diazepane-1-carboxylate CAS Name: 4-(2-fluoroethyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-fluoroethyl)-1,4-diazepane-1-carboxylate Traditional Name: 4-(2-fluoroethyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester Formula: C12H23FN2O2 MolecularWeight: 246.321623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCN(CC1)CCF

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCN(CC1)CCF

InChI

InChI=1S/C12H23FN2O2/c1-12(2,3)17-11(16)15-7-4-6-14(8-5-13)9-10-15/h4-10H2,1-3H3