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

Systemtic Name: methyl (3R)-2-[2-(3,4-dimethoxyphenyl)carbonyloxyethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-(3,4-dimethoxybenzoyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[2-[(3,4-dimethoxyphenyl)-oxomethoxy]-1-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-(3,4-dimethoxybenzoyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-(2-veratroyloxyacetyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C22H23NO7 MolecularWeight: 413.42052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)N2CC3=CC=CC=C3CC2C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)N2CC3=CC=CC=C3C[C@@H]2C(=O)OC)OC

InChI

InChI=1S/C22H23NO7/c1-27-18-9-8-15(11-19(18)28-2)21(25)30-13-20(24)23-12-16-7-5-4-6-14(16)10-17(23)22(26)29-3/h4-9,11,17H,10,12-13H2,1-3H3/t17-/m1/s1