1-[[2,4-bis(fluoranyl)phenyl]-thiophen-3-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[[2,4-bis(fluoranyl)phenyl]-thiophen-3-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2,4-difluorophenyl)-(3-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2,4-difluorophenyl)-(3-thiophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-difluorophenyl)-thiophen-3-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2,4-difluorophenyl)-(3-thienyl)methyl]pipecolinic acid Formula: C17H17F2NO2S MolecularWeight: 337.384186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CSC=C2)C3=C(C=C(C=C3)F)F

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CSC=C2)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C17H17F2NO2S/c18-12-4-5-13(14(19)9-12)16(11-6-8-23-10-11)20-7-2-1-3-15(20)17(21)22/h4-6,8-10,15-16H,1-3,7H2,(H,21,22)