4-fluoranyl-3-[1-(4-methyl-2-oxidanyl-phenyl)ethylamino]benzoic acid

Systemtic Name: 4-fluoranyl-3-[1-(4-methyl-2-oxidanyl-phenyl)ethylamino]benzoic acid Openeye Name: 4-fluoro-3-[1-(2-hydroxy-4-methyl-phenyl)ethylamino]benzoic acid CAS Name: 4-fluoro-3-[1-(2-hydroxy-4-methylphenyl)ethylamino]benzoic acid IUPAC Name: 4-fluoro-3-[1-(2-hydroxy-4-methylphenyl)ethylamino]benzoic acid Traditional Name: 4-fluoro-3-[1-(2-hydroxy-4-methyl-phenyl)ethylamino]benzoic acid Formula: C16H16FNO3 MolecularWeight: 289.301543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)NC2=C(C=CC(=C2)C(=O)O)F)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)NC2=C(C=CC(=C2)C(=O)O)F)O

InChI

InChI=1S/C16H16FNO3/c1-9-3-5-12(15(19)7-9)10(2)18-14-8-11(16(20)21)4-6-13(14)17/h3-8,10,18-19H,1-2H3,(H,20,21)