4-fluoranyl-2-[4-oxidanyl-3-[(4-phenylphenyl)methyl]-2H-chromen-7-yl]benzoic acid

Systemtic Name: 4-fluoranyl-2-[4-oxidanyl-3-[(4-phenylphenyl)methyl]-2H-chromen-7-yl]benzoic acid Openeye Name: 4-fluoro-2-[4-hydroxy-3-[(4-phenylphenyl)methyl]-2H-chromen-7-yl]benzoic acid CAS Name: 4-fluoro-2-[4-hydroxy-3-[(4-phenylphenyl)methyl]-2H-1-benzopyran-7-yl]benzoic acid IUPAC Name: 4-fluoro-2-[4-hydroxy-3-[(4-phenylphenyl)methyl]-2H-chromen-7-yl]benzoic acid Traditional Name: 4-fluoro-2-[4-hydroxy-3-(4-phenylbenzyl)-2H-chromen-7-yl]benzoic acid Formula: C29H21FO4 MolecularWeight: 452.473043

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(C2=C(O1)C=C(C=C2)C3=C(C=CC(=C3)F)C(=O)O)O)CC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1C(=C(C2=C(O1)C=C(C=C2)C3=C(C=CC(=C3)F)C(=O)O)O)CC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H21FO4/c30-23-11-13-24(29(32)33)26(16-23)21-10-12-25-27(15-21)34-17-22(28(25)31)14-18-6-8-20(9-7-18)19-4-2-1-3-5-19/h1-13,15-16,31H,14,17H2,(H,32,33)