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

Systemtic Name: bis(phenylmethyl) 2-(2-phenyl-3,4-dihydro-1H-isoquinolin-1-yl)propanedioate Openeye Name: dibenzyl 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 bis(phenylmethyl) ester IUPAC Name: dibenzyl 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 dibenzyl ester Formula: C32H29NO4 MolecularWeight: 491.57696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)C(C(=O)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)C(C(=O)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H29NO4/c34-31(36-22-24-12-4-1-5-13-24)29(32(35)37-23-25-14-6-2-7-15-25)30-28-19-11-10-16-26(28)20-21-33(30)27-17-8-3-9-18-27/h1-19,29-30H,20-23H2