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

Systemtic Name: methyl (3R)-2-[2-(4-methoxycarbonylphenoxy)ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-(4-methoxycarbonylphenoxy)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[2-(4-methoxycarbonylphenoxy)-1-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-(4-methoxycarbonylphenoxy)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[2-(4-carbomethoxyphenoxy)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C21H21NO6 MolecularWeight: 383.39454

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=CC=CC=C2CN1C(=O)COC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO6/c1-26-20(24)14-7-9-17(10-8-14)28-13-19(23)22-12-16-6-4-3-5-15(16)11-18(22)21(25)27-2/h3-10,18H,11-13H2,1-2H3/t18-/m1/s1