1-adamantylmethyl 2,3,4-tris(fluoranyl)benzoate

Systemtic Name: 1-adamantylmethyl 2,3,4-tris(fluoranyl)benzoate Openeye Name: 1-adamantylmethyl 2,3,4-trifluorobenzoate CAS Name: 2,3,4-trifluorobenzoic acid 1-adamantylmethyl ester IUPAC Name: 1-adamantylmethyl 2,3,4-trifluorobenzoate Traditional Name: 2,3,4-trifluorobenzoic acid 1-adamantylmethyl ester Formula: C18H19F3O2 MolecularWeight: 324.33747

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)COC(=O)C4=C(C(=C(C=C4)F)F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)COC(=O)C4=C(C(=C(C=C4)F)F)F

InChI

InChI=1S/C18H19F3O2/c19-14-2-1-13(15(20)16(14)21)17(22)23-9-18-6-10-3-11(7-18)5-12(4-10)8-18/h1-2,10-12H,3-9H2