1-[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylpiperidine-3-carboxylic acid

Systemtic Name: 1-[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylpiperidine-3-carboxylic acid Openeye Name: 1-[2-(difluoromethylsulfanyl)benzoyl]piperidine-3-carboxylic acid CAS Name: 1-[[2-(difluoromethylthio)phenyl]-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(difluoromethylsulfanyl)benzoyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(difluoromethylthio)benzoyl]nipecotic acid Formula: C14H15F2NO3S MolecularWeight: 315.335606

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CC=C2SC(F)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CC=C2SC(F)F)C(=O)O

InChI

InChI=1S/C14H15F2NO3S/c15-14(16)21-11-6-2-1-5-10(11)12(18)17-7-3-4-9(8-17)13(19)20/h1-2,5-6,9,14H,3-4,7-8H2,(H,19,20)