diethyl 2-(2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)propanedioate

Systemtic Name: diethyl 2-(2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)propanedioate Openeye Name: diethyl 2-(2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)propanedioate CAS Name: 2-(2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)propanedioate Traditional Name: 2-(2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)malonic acid diethyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO4/c1-3-26-21(24)19(22(25)27-4-2)20-18-13-9-8-10-16(18)14-15-23(20)17-11-6-5-7-12-17/h5-13,19-20H,3-4,14-15H2,1-2H3