2-[(3-fluoranyl-4-methyl-phenyl)carbonylamino]terephthalic acid

Systemtic Name: 2-[(3-fluoranyl-4-methyl-phenyl)carbonylamino]terephthalic acid Openeye Name: 2-[(3-fluoro-4-methyl-benzoyl)amino]terephthalic acid CAS Name: 2-[[(3-fluoro-4-methylphenyl)-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[(3-fluoro-4-methylbenzoyl)amino]terephthalic acid Traditional Name: 2-[(3-fluoro-4-methyl-benzoyl)amino]terephthalic acid Formula: C16H12FNO5 MolecularWeight: 317.268583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12FNO5/c1-8-2-3-9(6-12(8)17)14(19)18-13-7-10(15(20)21)4-5-11(13)16(22)23/h2-7H,1H3,(H,18,19)(H,20,21)(H,22,23)