O3,O5-dimethyl O4-[(2R)-1-oxidanylidene-1-phenyl-propan-2-yl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate

Systemtic Name: O3,O5-dimethyl O4-[(2R)-1-oxidanylidene-1-phenyl-propan-2-yl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate Openeye Name: O3,O5-dimethyl O4-[(1R)-1-methyl-2-oxo-2-phenyl-ethyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate CAS Name: 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylic acid O3,O5-dimethyl ester O4-[(2R)-1-oxo-1-phenylpropan-2-yl] ester IUPAC Name: 3-O,5-O-dimethyl 4-O-[(2R)-1-oxo-1-phenylpropan-2-yl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate Traditional Name: 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylic acid O4-[(1R)-2-keto-1-methyl-2-phenyl-ethyl] ester O3,O5-dimethyl ester Formula: C21H23NO7 MolecularWeight: 401.40982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)C(=O)OC(C)C(=O)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)C(=O)O[C@H](C)C(=O)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C21H23NO7/c1-11-15(19(24)27-4)17(16(12(2)22-11)20(25)28-5)21(26)29-13(3)18(23)14-9-7-6-8-10-14/h6-10,13,17,22H,1-5H3/t13-/m1/s1