3-[4-[(5-fluoranyl-3-methyl-2-oxidanyl-phenyl)carbonylamino]phenyl]propanoic acid

Systemtic Name: 3-[4-[(5-fluoranyl-3-methyl-2-oxidanyl-phenyl)carbonylamino]phenyl]propanoic acid Openeye Name: 3-[4-[(5-fluoro-2-hydroxy-3-methyl-benzoyl)amino]phenyl]propanoic acid CAS Name: 3-[4-[[(5-fluoro-2-hydroxy-3-methylphenyl)-oxomethyl]amino]phenyl]propanoic acid IUPAC Name: 3-[4-[(5-fluoro-2-hydroxy-3-methylbenzoyl)amino]phenyl]propanoic acid Traditional Name: 3-[4-[(5-fluoro-2-hydroxy-3-methyl-benzoyl)amino]phenyl]propionic acid Formula: C17H16FNO4 MolecularWeight: 317.311643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16FNO4/c1-10-8-12(18)9-14(16(10)22)17(23)19-13-5-2-11(3-6-13)4-7-15(20)21/h2-3,5-6,8-9,22H,4,7H2,1H3,(H,19,23)(H,20,21)