O5-[3-(4-imidazol-1-ylphenoxy)propyl] O3-methyl 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-[3-(4-imidazol-1-ylphenoxy)propyl] O3-methyl 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-[3-(4-imidazol-1-ylphenoxy)propyl] O3-methyl 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[3-[4-(1-imidazolyl)phenoxy]propyl] ester O3-methyl ester IUPAC Name: 5-O-[3-(4-imidazol-1-ylphenoxy)propyl] 3-O-methyl 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[3-(4-imidazol-1-ylphenoxy)propyl] ester O3-methyl ester Formula: C23H27N3O5 MolecularWeight: 425.47758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=C(NC(=C1C(=O)OCCCOC2=CC=C(C=C2)N3C=CN=C3)C)C)C(=O)OC

Isomeric SMILES

CC1C(=C(NC(=C1C(=O)OCCCOC2=CC=C(C=C2)N3C=CN=C3)C)C)C(=O)OC

InChI

InChI=1S/C23H27N3O5/c1-15-20(22(27)29-4)16(2)25-17(3)21(15)23(28)31-13-5-12-30-19-8-6-18(7-9-19)26-11-10-24-14-26/h6-11,14-15,25H,5,12-13H2,1-4H3