O5-tert-butyl O3-(2-fluoranyl-2-phenoxy-ethyl) 4-fluoranyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-tert-butyl O3-(2-fluoranyl-2-phenoxy-ethyl) 4-fluoranyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-tert-butyl O3-(2-fluoro-2-phenoxy-ethyl) 4-fluoro-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-fluoro-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-tert-butyl ester O3-(2-fluoro-2-phenoxyethyl) ester IUPAC Name: 5-O-tert-butyl 3-O-(2-fluoro-2-phenoxyethyl) 4-fluoro-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-fluoro-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-tert-butyl ester O3-(2-fluoro-2-phenoxy-ethyl) ester Formula: C21H25F2NO5 MolecularWeight: 409.423706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC(C)(C)C)F)C(=O)OCC(OC2=CC=CC=C2)F

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC(C)(C)C)F)C(=O)OCC(OC2=CC=CC=C2)F

InChI

InChI=1S/C21H25F2NO5/c1-12-16(18(23)17(13(2)24-12)20(26)29-21(3,4)5)19(25)27-11-15(22)28-14-9-7-6-8-10-14/h6-10,15,18,24H,11H2,1-5H3