tert-butyl 4-[4-(2-ethyl-3-fluoranyl-phenyl)carbonyloxybutyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(2-ethyl-3-fluoranyl-phenyl)carbonyloxybutyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(2-ethyl-3-fluoro-benzoyl)oxybutyl]piperazine-1-carboxylate CAS Name: 4-[4-[(2-ethyl-3-fluorophenyl)-oxomethoxy]butyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(2-ethyl-3-fluorobenzoyl)oxybutyl]piperazine-1-carboxylate Traditional Name: 4-[4-(2-ethyl-3-fluoro-benzoyl)oxybutyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H33FN2O4 MolecularWeight: 408.506823

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1F)C(=O)OCCCCN2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(C=CC=C1F)C(=O)OCCCCN2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H33FN2O4/c1-5-17-18(9-8-10-19(17)23)20(26)28-16-7-6-11-24-12-14-25(15-13-24)21(27)29-22(2,3)4/h8-10H,5-7,11-16H2,1-4H3