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1-[furan-2-yl-[4-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylic acid

1-[furan-2-yl-[4-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylic acid

Systemtic Name:1-[furan-2-yl-[4-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylic acid
Openeye Name:1-[2-furyl-[4-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylic acid
CAS Name:1-[2-furanyl-[4-(trifluoromethyl)phenyl]methyl]-4-piperidinecarboxylic acid
IUPAC Name:1-[furan-2-yl-[4-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylic acid
Traditional Name:1-[2-furyl-[4-(trifluoromethyl)phenyl]methyl]isonipecotic acid
Formula: C18H18F3NO3
MolecularWeight: 353.33563
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC=CO3


Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC=CO3


InChI

InChI=1S/C18H18F3NO3/c19-18(20,21)14-5-3-12(4-6-14)16(15-2-1-11-25-15)22-9-7-13(8-10-22)17(23)24/h1-6,11,13,16H,7-10H2,(H,23,24)


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