2-fluoranyl-4-[(2,2,4,4,8-pentamethyl-3H-chromen-6-yl)carbamoyl]benzoic acid

Systemtic Name: 2-fluoranyl-4-[(2,2,4,4,8-pentamethyl-3H-chromen-6-yl)carbamoyl]benzoic acid Openeye Name: 2-fluoro-4-[(2,2,4,4,8-pentamethylchroman-6-yl)carbamoyl]benzoic acid CAS Name: 2-fluoro-4-[oxo-[(2,2,4,4,8-pentamethyl-3,4-dihydro-2H-1-benzopyran-6-yl)amino]methyl]benzoic acid IUPAC Name: 2-fluoro-4-[(2,2,4,4,8-pentamethyl-3H-chromen-6-yl)carbamoyl]benzoic acid Traditional Name: 2-fluoro-4-[(2,2,4,4,8-pentamethylchroman-6-yl)carbamoyl]benzoic acid Formula: C22H24FNO4 MolecularWeight: 385.428663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)NC(=O)C3=CC(=C(C=C3)C(=O)O)F)C(CC(O2)(C)C)(C)C

Isomeric SMILES

CC1=C2C(=CC(=C1)NC(=O)C3=CC(=C(C=C3)C(=O)O)F)C(CC(O2)(C)C)(C)C

InChI

InChI=1S/C22H24FNO4/c1-12-8-14(10-16-18(12)28-22(4,5)11-21(16,2)3)24-19(25)13-6-7-15(20(26)27)17(23)9-13/h6-10H,11H2,1-5H3,(H,24,25)(H,26,27)