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

Systemtic Name: methyl (3R)-2-[2-[2-(4-methanoylphenoxy)ethanoyloxy]ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-[2-(4-formylphenoxy)acetyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[2-[2-(4-formylphenoxy)-1-oxoethoxy]-1-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-[2-(4-formylphenoxy)acetyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[2-[2-(4-formylphenoxy)acetyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C22H21NO7 MolecularWeight: 411.40464

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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=O

Isomeric SMILES

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

InChI

InChI=1S/C22H21NO7/c1-28-22(27)19-10-16-4-2-3-5-17(16)11-23(19)20(25)13-30-21(26)14-29-18-8-6-15(12-24)7-9-18/h2-9,12,19H,10-11,13-14H2,1H3/t19-/m1/s1