O4-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl] O3,O5-dimethyl (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate

Systemtic Name: O4-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl] O3,O5-dimethyl (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate Openeye Name: O4-[2-(4-fluorophenyl)-2-oxo-ethyl] O3,O5-dimethyl (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate CAS Name: (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylic acid O4-[2-(4-fluorophenyl)-2-oxoethyl] ester O3,O5-dimethyl ester IUPAC Name: 4-O-[2-(4-fluorophenyl)-2-oxoethyl] 3-O,5-O-dimethyl (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate Traditional Name: (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylic acid O4-[2-(4-fluorophenyl)-2-keto-ethyl] ester O3,O5-dimethyl ester Formula: C20H20FNO7 MolecularWeight: 405.373703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OC)C(=O)OCC(=O)C2=CC=C(C=C2)F)C(=O)OC)C

Isomeric SMILES

CC1=NC(=C([C@H](C1C(=O)OC)C(=O)OCC(=O)C2=CC=C(C=C2)F)C(=O)OC)C

InChI

InChI=1S/C20H20FNO7/c1-10-15(18(24)27-3)17(16(11(2)22-10)19(25)28-4)20(26)29-9-14(23)12-5-7-13(21)8-6-12/h5-8,15,17H,9H2,1-4H3/t15?,17-/m0/s1