tetrakis(phenylmethyl) perylene-3,4,9,10-tetracarboxylate

Systemtic Name: tetrakis(phenylmethyl) perylene-3,4,9,10-tetracarboxylate Openeye Name: tetrabenzyl perylene-3,4,9,10-tetracarboxylate CAS Name: perylene-3,4,9,10-tetracarboxylic acid tetrakis(phenylmethyl) ester IUPAC Name: tetrabenzyl perylene-3,4,9,10-tetracarboxylate Traditional Name: perylene-3,4,9,10-tetracarboxylic acid tetrabenzyl ester Formula: C52H36O8 MolecularWeight: 788.83744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=C6C4=CC=C(C6=C(C=C5)C(=O)OCC7=CC=CC=C7)C(=O)OCC8=CC=CC=C8)C(=O)OCC9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=C6C4=CC=C(C6=C(C=C5)C(=O)OCC7=CC=CC=C7)C(=O)OCC8=CC=CC=C8)C(=O)OCC9=CC=CC=C9

InChI

InChI=1S/C52H36O8/c53-49(57-29-33-13-5-1-6-14-33)41-25-21-37-39-23-27-43(51(55)59-31-35-17-9-3-10-18-35)48-44(52(56)60-32-36-19-11-4-12-20-36)28-24-40(46(39)48)38-22-26-42(47(41)45(37)38)50(54)58-30-34-15-7-2-8-16-34/h1-28H,29-32H2