4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(1-phenylethenyl)pentanoic acid

Systemtic Name: 4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(1-phenylethenyl)pentanoic acid Openeye Name: 4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-2-(1-phenylvinyl)pentanoic acid CAS Name: 4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(1-phenylethenyl)pentanoic acid IUPAC Name: 4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(1-phenylethenyl)pentanoic acid Traditional Name: 2-[2-(5-fluoro-2-methoxy-phenyl)-2-methyl-propyl]-2-hydroxy-3-phenyl-but-3-enoic acid Formula: C21H23FO4 MolecularWeight: 358.403323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C(=C)C1=CC=CC=C1)(C(=O)O)O)C2=C(C=CC(=C2)F)OC

Isomeric SMILES

CC(C)(CC(C(=C)C1=CC=CC=C1)(C(=O)O)O)C2=C(C=CC(=C2)F)OC

InChI

InChI=1S/C21H23FO4/c1-14(15-8-6-5-7-9-15)21(25,19(23)24)13-20(2,3)17-12-16(22)10-11-18(17)26-4/h5-12,25H,1,13H2,2-4H3,(H,23,24)