methyl (3R)-2-[2-[2-(4-cyanophenoxy)ethanoyloxy]ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl (3R)-2-[2-[2-(4-cyanophenoxy)ethanoyloxy]ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-[2-(4-cyanophenoxy)acetyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[2-[2-(4-cyanophenoxy)-1-oxoethoxy]-1-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-[2-(4-cyanophenoxy)acetyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[2-[2-(4-cyanophenoxy)acetyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=CC=CC=C2CN1C(=O)COC(=O)COC3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)[C@H]1CC2=CC=CC=C2CN1C(=O)COC(=O)COC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H20N2O6/c1-28-22(27)19-10-16-4-2-3-5-17(16)12-24(19)20(25)13-30-21(26)14-29-18-8-6-15(11-23)7-9-18/h2-9,19H,10,12-14H2,1H3/t19-/m1/s1