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4-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]benzoic acid

4-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]benzoic acid

Systemtic Name:4-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]benzoic acid
Openeye Name:4-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]benzoic acid
CAS Name:4-[4-[4,4-bis(4-fluorophenyl)butyl]-1-piperazinyl]benzoic acid
IUPAC Name:4-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]benzoic acid
Traditional Name:4-[4-[4,4-bis(4-fluorophenyl)butyl]piperazino]benzoic acid
Formula: C27H28F2N2O2
MolecularWeight: 450.520226
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C4=CC=C(C=C4)C(=O)O


Isomeric SMILES

C1CN(CCN1CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C4=CC=C(C=C4)C(=O)O


InChI

InChI=1S/C27H28F2N2O2/c28-23-9-3-20(4-10-23)26(21-5-11-24(29)12-6-21)2-1-15-30-16-18-31(19-17-30)25-13-7-22(8-14-25)27(32)33/h3-14,26H,1-2,15-19H2,(H,32,33)


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