methyl 2-[4-(4-acetyloxyphenyl)-3-fluoranyl-phenyl]-3,3,3-trideuterio-propanoate

Systemtic Name: methyl 2-[4-(4-acetyloxyphenyl)-3-fluoranyl-phenyl]-3,3,3-trideuterio-propanoate Openeye Name: methyl 2-[4-(4-acetoxyphenyl)-3-fluoro-phenyl]-3,3,3-trideuterio-propanoate CAS Name: 2-[4-(4-acetyloxyphenyl)-3-fluorophenyl]-3,3,3-trideuteriopropanoic acid methyl ester IUPAC Name: methyl 2-[4-(4-acetyloxyphenyl)-3-fluorophenyl]-3,3,3-trideuteriopropanoate Traditional Name: 2-[4-(4-acetoxyphenyl)-3-fluoro-phenyl]-3,3,3-trideuterio-propionic acid methyl ester Formula: C18H17FO4 MolecularWeight: 319.342069

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H]C([2H])([2H])C(C1=CC(=C(C=C1)C2=CC=C(C=C2)OC(=O)C)F)C(=O)OC

InChI

InChI=1S/C18H17FO4/c1-11(18(21)22-3)14-6-9-16(17(19)10-14)13-4-7-15(8-5-13)23-12(2)20/h4-11H,1-3H3/i1D3