bis(phenylmethyl) 2-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexylidene]propanedioate

Systemtic Name: bis(phenylmethyl) 2-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexylidene]propanedioate Openeye Name: dibenzyl 2-[6-(1,3-dioxoisoindolin-2-yl)hexylidene]propanedioate CAS Name: 2-[6-(1,3-dioxo-2-isoindolyl)hexylidene]propanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-[6-(1,3-dioxoisoindol-2-yl)hexylidene]propanedioate Traditional Name: 2-(6-phthalimidohexylidene)malonic acid dibenzyl ester Formula: C31H29NO6 MolecularWeight: 511.56506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(=CCCCCCN2C(=O)C3=CC=CC=C3C2=O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(=CCCCCCN2C(=O)C3=CC=CC=C3C2=O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H29NO6/c33-28-25-17-10-11-18-26(25)29(34)32(28)20-12-2-1-9-19-27(30(35)37-21-23-13-5-3-6-14-23)31(36)38-22-24-15-7-4-8-16-24/h3-8,10-11,13-19H,1-2,9,12,20-22H2