methyl 5-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-5-oxo-pentanoate CAS Name: 5-[4-[4,4-bis(4-fluorophenyl)butyl]-1-piperazinyl]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-5-oxopentanoate Traditional Name: 5-[4-[4,4-bis(4-fluorophenyl)butyl]piperazino]-5-keto-valeric acid methyl ester Formula: C26H32F2N2O3 MolecularWeight: 458.540686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32F2N2O3/c1-33-26(32)6-2-5-25(31)30-18-16-29(17-19-30)15-3-4-24(20-7-11-22(27)12-8-20)21-9-13-23(28)14-10-21/h7-14,24H,2-6,15-19H2,1H3