bis(phenylmethyl) 3-oxidanyl-3-(phenylmethyl)heptanedioate

Systemtic Name: bis(phenylmethyl) 3-oxidanyl-3-(phenylmethyl)heptanedioate Openeye Name: dibenzyl 3-benzyl-3-hydroxy-heptanedioate CAS Name: 3-hydroxy-3-(phenylmethyl)heptanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 3-benzyl-3-hydroxyheptanedioate Traditional Name: 3-benzyl-3-hydroxy-pimelic acid dibenzyl ester Formula: C28H30O5 MolecularWeight: 446.5348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CCCC(=O)OCC2=CC=CC=C2)(CC(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CCCC(=O)OCC2=CC=CC=C2)(CC(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C28H30O5/c29-26(32-21-24-13-6-2-7-14-24)17-10-18-28(31,19-23-11-4-1-5-12-23)20-27(30)33-22-25-15-8-3-9-16-25/h1-9,11-16,31H,10,17-22H2