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3-[4-[3,3-bis(4-fluorophenyl)propyl]piperazin-1-yl]benzoic acid

3-[4-[3,3-bis(4-fluorophenyl)propyl]piperazin-1-yl]benzoic acid

Systemtic Name:3-[4-[3,3-bis(4-fluorophenyl)propyl]piperazin-1-yl]benzoic acid
Openeye Name:3-[4-[3,3-bis(4-fluorophenyl)propyl]piperazin-1-yl]benzoic acid
CAS Name:3-[4-[3,3-bis(4-fluorophenyl)propyl]-1-piperazinyl]benzoic acid
IUPAC Name:3-[4-[3,3-bis(4-fluorophenyl)propyl]piperazin-1-yl]benzoic acid
Traditional Name:3-[4-[3,3-bis(4-fluorophenyl)propyl]piperazino]benzoic acid
Formula: C26H26F2N2O2
MolecularWeight: 436.493646
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C4=CC=CC(=C4)C(=O)O


Isomeric SMILES

C1CN(CCN1CCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C4=CC=CC(=C4)C(=O)O


InChI

InChI=1S/C26H26F2N2O2/c27-22-8-4-19(5-9-22)25(20-6-10-23(28)11-7-20)12-13-29-14-16-30(17-15-29)24-3-1-2-21(18-24)26(31)32/h1-11,18,25H,12-17H2,(H,31,32)


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