O3-ethyl O2-methyl 6-(diethoxyphosphoryloxymethyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylate

Systemtic Name: O3-ethyl O2-methyl 6-(diethoxyphosphoryloxymethyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylate Openeye Name: O3-ethyl O2-methyl 6-(diethoxyphosphoryloxymethyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylate CAS Name: 6-(diethoxyphosphoryloxymethyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylic acid O3-ethyl ester O2-methyl ester IUPAC Name: 3-O-ethyl 2-O-methyl 6-(diethoxyphosphoryloxymethyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylate Traditional Name: 6-(diethoxyphosphoryloxymethyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylic acid O3-ethyl ester O2-methyl ester Formula: C19H28NO8P MolecularWeight: 429.401281

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC2=C(CN1C(=O)OC)C=CC(=C2)COP(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)C1CC2=C(CN1C(=O)OC)C=CC(=C2)COP(=O)(OCC)OCC

InChI

InChI=1S/C19H28NO8P/c1-5-25-18(21)17-11-16-10-14(13-28-29(23,26-6-2)27-7-3)8-9-15(16)12-20(17)19(22)24-4/h8-10,17H,5-7,11-13H2,1-4H3