methyl (2S)-3,3,3-tris(fluoranyl)-2-methoxy-2-(pyridin-1-ium-2-ylamino)propanoate

Systemtic Name: methyl (2S)-3,3,3-tris(fluoranyl)-2-methoxy-2-(pyridin-1-ium-2-ylamino)propanoate Openeye Name: methyl (2S)-3,3,3-trifluoro-2-methoxy-2-(pyridin-1-ium-2-ylamino)propanoate CAS Name: (2S)-3,3,3-trifluoro-2-methoxy-2-(2-pyridin-1-iumylamino)propanoic acid methyl ester IUPAC Name: methyl (2S)-3,3,3-trifluoro-2-methoxy-2-(pyridin-1-ium-2-ylamino)propanoate Traditional Name: (2S)-3,3,3-trifluoro-2-methoxy-2-(pyridin-1-ium-2-ylamino)propionic acid methyl ester Formula: C10H12F3N2O3+ MolecularWeight: 265.20909

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(F)(F)F)(NC1=CC=CC=[NH+]1)OC

Isomeric SMILES

COC(=O)[C@](C(F)(F)F)(NC1=CC=CC=[NH+]1)OC

InChI

InChI=1S/C10H11F3N2O3/c1-17-8(16)9(18-2,10(11,12)13)15-7-5-3-4-6-14-7/h3-6H,1-2H3,(H,14,15)/p+1/t9-/m0/s1