O3,O5-diethyl O4-(phenylmethyl) 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate

Systemtic Name: O3,O5-diethyl O4-(phenylmethyl) 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate Openeye Name: O4-benzyl O3,O5-diethyl 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-diethyl ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 3-O,5-O-diethyl 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate Traditional Name: 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylic acid O4-benzyl ester O3,O5-diethyl ester Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C(=O)OCC2=CC=CC=C2)C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C(=O)OCC2=CC=CC=C2)C(=O)OCC)C)C

InChI

InChI=1S/C21H25NO6/c1-5-26-19(23)16-13(3)22-14(4)17(20(24)27-6-2)18(16)21(25)28-12-15-10-8-7-9-11-15/h7-11,18,22H,5-6,12H2,1-4H3