dimethyl (4S)-4-(3-phenylmethoxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl (4S)-4-(3-phenylmethoxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl (4S)-4-(3-benzyloxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylate CAS Name: (4S)-4-(3-phenylmethoxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4S)-4-(3-phenylmethoxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylate Traditional Name: (4S)-4-(3-benzoxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C22H21NO5 MolecularWeight: 379.40584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C=NC=C(C1C2=CC(=CC=C2)OCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1C=NC=C([C@@H]1C2=CC(=CC=C2)OCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H21NO5/c1-26-21(24)18-12-23-13-19(22(25)27-2)20(18)16-9-6-10-17(11-16)28-14-15-7-4-3-5-8-15/h3-13,18,20H,14H2,1-2H3/t18?,20-/m1/s1