4-[[3-(trifluoromethyl)phenyl]methylamino]oxane-4-carboxylic acid

Systemtic Name: 4-[[3-(trifluoromethyl)phenyl]methylamino]oxane-4-carboxylic acid Openeye Name: 4-[[3-(trifluoromethyl)phenyl]methylamino]tetrahydropyran-4-carboxylic acid CAS Name: 4-[[3-(trifluoromethyl)phenyl]methylamino]-4-oxanecarboxylic acid IUPAC Name: 4-[[3-(trifluoromethyl)phenyl]methylamino]oxane-4-carboxylic acid Traditional Name: 4-[[3-(trifluoromethyl)benzyl]amino]tetrahydropyran-4-carboxylic acid Formula: C14H16F3NO3 MolecularWeight: 303.27695

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C(=O)O)NCC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

C1COCCC1(C(=O)O)NCC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C14H16F3NO3/c15-14(16,17)11-3-1-2-10(8-11)9-18-13(12(19)20)4-6-21-7-5-13/h1-3,8,18H,4-7,9H2,(H,19,20)