(2S)-2-azanyl-2-(fluoranylmethyl)-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid

Systemtic Name: (2S)-2-azanyl-2-(fluoranylmethyl)-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: (2S)-2-amino-2-(fluoromethyl)-3-(5-hydroxy-1H-indol-3-yl)propanoic acid CAS Name: (2S)-2-amino-2-(fluoromethyl)-3-(5-hydroxy-1H-indol-3-yl)propanoic acid IUPAC Name: (2S)-2-amino-2-(fluoromethyl)-3-(5-hydroxy-1H-indol-3-yl)propanoic acid Traditional Name: (2S)-2-amino-2-(fluoromethyl)-3-(5-hydroxy-1H-indol-3-yl)propionic acid Formula: C12H13FN2O3 MolecularWeight: 252.241623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=CN2)CC(CF)(C(=O)O)N

Isomeric SMILES

C1=CC2=C(C=C1O)C(=CN2)C[C@@](CF)(C(=O)O)N

InChI

InChI=1S/C12H13FN2O3/c13-6-12(14,11(17)18)4-7-5-15-10-2-1-8(16)3-9(7)10/h1-3,5,15-16H,4,6,14H2,(H,17,18)/t12-/m1/s1