methyl 4-[4,4-bis(4-fluorophenyl)butyl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[4,4-bis(4-fluorophenyl)butyl]piperazine-1-carboxylate Openeye Name: methyl 4-[4,4-bis(4-fluorophenyl)butyl]piperazine-1-carboxylate CAS Name: 4-[4,4-bis(4-fluorophenyl)butyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[4,4-bis(4-fluorophenyl)butyl]piperazine-1-carboxylate Traditional Name: 4-[4,4-bis(4-fluorophenyl)butyl]piperazine-1-carboxylic acid methyl ester Formula: C22H26F2N2O2 MolecularWeight: 388.450846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(CC1)CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)N1CCN(CC1)CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26F2N2O2/c1-28-22(27)26-15-13-25(14-16-26)12-2-3-21(17-4-8-19(23)9-5-17)18-6-10-20(24)11-7-18/h4-11,21H,2-3,12-16H2,1H3