2-fluoranyl-3,3,3-triphenyl-propanoic acid; methoxybenzene

Systemtic Name: 2-fluoranyl-3,3,3-triphenyl-propanoic acid; methoxybenzene Openeye Name: anisole; 2-fluoro-3,3,3-triphenyl-propanoic acid CAS Name: 2-fluoro-3,3,3-triphenylpropanoic acid; methoxybenzene IUPAC Name: anisole; 2-fluoro-3,3,3-triphenylpropanoic acid Traditional Name: anisole; 2-fluoro-3,3,3-triphenyl-propionic acid Formula: C28H25FO3 MolecularWeight: 428.494703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C(C(=O)O)F

Isomeric SMILES

COC1=CC=CC=C1.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C(C(=O)O)F

InChI

InChI=1S/C21H17FO2.C7H8O/c22-19(20(23)24)21(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-8-7-5-3-2-4-6-7/h1-15,19H,(H,23,24);2-6H,1H3