2-azanyl-2-[3,4,5-tris(fluoranyl)-2-methyl-phenyl]ethanoic acid

Systemtic Name: 2-azanyl-2-[3,4,5-tris(fluoranyl)-2-methyl-phenyl]ethanoic acid Openeye Name: 2-amino-2-(3,4,5-trifluoro-2-methyl-phenyl)acetic acid CAS Name: 2-amino-2-(3,4,5-trifluoro-2-methylphenyl)acetic acid IUPAC Name: 2-amino-2-(3,4,5-trifluoro-2-methylphenyl)acetic acid Traditional Name: 2-amino-2-(3,4,5-trifluoro-2-methyl-phenyl)acetic acid Formula: C9H8F3NO2 MolecularWeight: 219.16053

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(C(=O)O)N)F)F)F

Isomeric SMILES

CC1=C(C(=C(C=C1C(C(=O)O)N)F)F)F

InChI

InChI=1S/C9H8F3NO2/c1-3-4(8(13)9(14)15)2-5(10)7(12)6(3)11/h2,8H,13H2,1H3,(H,14,15)