2-azanyl-2-(fluoranylmethyl)-3-(5-methyl-5-oxidanyl-cyclohexa-1,3-dien-1-yl)propanoic acid

Systemtic Name: 2-azanyl-2-(fluoranylmethyl)-3-(5-methyl-5-oxidanyl-cyclohexa-1,3-dien-1-yl)propanoic acid Openeye Name: 2-amino-2-(fluoromethyl)-3-(5-hydroxy-5-methyl-cyclohexa-1,3-dien-1-yl)propanoic acid CAS Name: 2-amino-2-(fluoromethyl)-3-(5-hydroxy-5-methyl-1-cyclohexa-1,3-dienyl)propanoic acid IUPAC Name: 2-amino-2-(fluoromethyl)-3-(5-hydroxy-5-methylcyclohexa-1,3-dien-1-yl)propanoic acid Traditional Name: 2-amino-2-(fluoromethyl)-3-(5-hydroxy-5-methyl-cyclohexa-1,3-dien-1-yl)propionic acid Formula: C11H16FNO3 MolecularWeight: 229.248043

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC=C1)CC(CF)(C(=O)O)N)O

Isomeric SMILES

CC1(CC(=CC=C1)CC(CF)(C(=O)O)N)O

InChI

InChI=1S/C11H16FNO3/c1-10(16)4-2-3-8(5-10)6-11(13,7-12)9(14)15/h2-4,16H,5-7,13H2,1H3,(H,14,15)