[2-fluoranyl-1-(3,4,5-trimethoxyphenyl)ethyl] 2,2-dimethylchromene-6-carboxylate

Systemtic Name: [2-fluoranyl-1-(3,4,5-trimethoxyphenyl)ethyl] 2,2-dimethylchromene-6-carboxylate Openeye Name: [2-fluoranyl-1-(3,4,5-trimethoxyphenyl)ethyl] 2,2-dimethylchromene-6-carboxylate CAS Name: 2,2-dimethyl-1-benzopyran-6-carboxylic acid [2-fluoranyl-1-(3,4,5-trimethoxyphenyl)ethyl] ester IUPAC Name: [2-fluoranyl-1-(3,4,5-trimethoxyphenyl)ethyl] 2,2-dimethylchromene-6-carboxylate Traditional Name: 2,2-dimethylchromene-6-carboxylic acid [2-fluoranyl-1-(3,4,5-trimethoxyphenyl)ethyl] ester Formula: C23H25FO6 MolecularWeight: 415.441938

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=C(O1)C=CC(=C2)C(=O)OC(CF)C3=CC(=C(C(=C3)OC)OC)OC)C

Isomeric SMILES

CC1(C=CC2=C(O1)C=CC(=C2)C(=O)OC(C[18F])C3=CC(=C(C(=C3)OC)OC)OC)C

InChI

InChI=1S/C23H25FO6/c1-23(2)9-8-14-10-15(6-7-17(14)30-23)22(25)29-20(13-24)16-11-18(26-3)21(28-5)19(12-16)27-4/h6-12,20H,13H2,1-5H3/i24-1