diethyl 2-[2-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinolin-1-yl]propanedioate

Systemtic Name: diethyl 2-[2-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinolin-1-yl]propanedioate Openeye Name: diethyl 2-[2-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinolin-1-yl]propanedioate CAS Name: 2-[2-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinolin-1-yl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinolin-1-yl]propanedioate Traditional Name: 2-[2-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinolin-1-yl]malonic acid diethyl ester Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1C2=CC=CC=C2CCN1C3=CC=C(C=C3)OC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1C2=CC=CC=C2CCN1C3=CC=C(C=C3)OC)C(=O)OCC

InChI

InChI=1S/C23H27NO5/c1-4-28-22(25)20(23(26)29-5-2)21-19-9-7-6-8-16(19)14-15-24(21)17-10-12-18(27-3)13-11-17/h6-13,20-21H,4-5,14-15H2,1-3H3