O4-tert-butyl O1-[(4-pentylphenyl)methyl] 2-fluoranyl-2,6-dimethyl-piperazine-1,4-dicarboxylate

Systemtic Name: O4-tert-butyl O1-[(4-pentylphenyl)methyl] 2-fluoranyl-2,6-dimethyl-piperazine-1,4-dicarboxylate Openeye Name: O4-tert-butyl O1-[(4-pentylphenyl)methyl] 2-fluoro-2,6-dimethyl-piperazine-1,4-dicarboxylate CAS Name: 2-fluoro-2,6-dimethylpiperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-[(4-pentylphenyl)methyl] ester IUPAC Name: 4-O-tert-butyl 1-O-[(4-pentylphenyl)methyl] 2-fluoro-2,6-dimethylpiperazine-1,4-dicarboxylate Traditional Name: 2-fluoro-2,6-dimethyl-piperazine-1,4-dicarboxylic acid O1-(4-amylbenzyl) ester O4-tert-butyl ester Formula: C24H37FN2O4 MolecularWeight: 436.559983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)COC(=O)N2C(CN(CC2(C)F)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)COC(=O)N2C(CN(CC2(C)F)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C24H37FN2O4/c1-7-8-9-10-19-11-13-20(14-12-19)16-30-22(29)27-18(2)15-26(17-24(27,6)25)21(28)31-23(3,4)5/h11-14,18H,7-10,15-17H2,1-6H3