ethyl 4-[5-(4-fluorophenyl)-5-pyridin-3-yl-pentyl]-2-methyl-piperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-(4-fluorophenyl)-5-pyridin-3-yl-pentyl]-2-methyl-piperazine-1-carboxylate Openeye Name: ethyl 4-[5-(4-fluorophenyl)-5-(3-pyridyl)pentyl]-2-methyl-piperazine-1-carboxylate CAS Name: 4-[5-(4-fluorophenyl)-5-(3-pyridinyl)pentyl]-2-methyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(4-fluorophenyl)-5-pyridin-3-ylpentyl]-2-methylpiperazine-1-carboxylate Traditional Name: 4-[5-(4-fluorophenyl)-5-(3-pyridyl)pentyl]-2-methyl-piperazine-1-carboxylic acid ethyl ester Formula: C24H32FN3O2 MolecularWeight: 413.528183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1C)CCCCC(C2=CC=C(C=C2)F)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1C)CCCCC(C2=CC=C(C=C2)F)C3=CN=CC=C3

InChI

InChI=1S/C24H32FN3O2/c1-3-30-24(29)28-16-15-27(18-19(28)2)14-5-4-8-23(21-7-6-13-26-17-21)20-9-11-22(25)12-10-20/h6-7,9-13,17,19,23H,3-5,8,14-16,18H2,1-2H3