(3-fluoranyl-4-methoxy-phenyl)methyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-4,5-dimethoxybenzoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxybenzoate Traditional Name: 4,5-dimethoxy-2-(pivaloylamino)benzoic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C22H26FNO6 MolecularWeight: 419.443343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC2=CC(=C(C=C2)OC)F)OC)OC

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC2=CC(=C(C=C2)OC)F)OC)OC

InChI

InChI=1S/C22H26FNO6/c1-22(2,3)21(26)24-16-11-19(29-6)18(28-5)10-14(16)20(25)30-12-13-7-8-17(27-4)15(23)9-13/h7-11H,12H2,1-6H3,(H,24,26)