prop-2-enyl 5-(1-adamantyl)-2-fluoranyl-4-methoxy-benzoate

Systemtic Name: prop-2-enyl 5-(1-adamantyl)-2-fluoranyl-4-methoxy-benzoate Openeye Name: allyl 5-(1-adamantyl)-2-fluoro-4-methoxy-benzoate CAS Name: 5-(1-adamantyl)-2-fluoro-4-methoxybenzoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 5-(1-adamantyl)-2-fluoro-4-methoxybenzoate Traditional Name: 5-(1-adamantyl)-2-fluoro-4-methoxy-benzoic acid allyl ester Formula: C21H25FO3 MolecularWeight: 344.419803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)F)C(=O)OCC=C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=C(C=C(C(=C1)F)C(=O)OCC=C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H25FO3/c1-3-4-25-20(23)16-8-17(19(24-2)9-18(16)22)21-10-13-5-14(11-21)7-15(6-13)12-21/h3,8-9,13-15H,1,4-7,10-12H2,2H3