[3,4,5,6-tetrakis(3-phenylpropanoyloxy)oxan-2-yl]methyl 3-phenylpropanoate

Systemtic Name: [3,4,5,6-tetrakis(3-phenylpropanoyloxy)oxan-2-yl]methyl 3-phenylpropanoate Openeye Name: [3,4,5,6-tetrakis(3-phenylpropanoyloxy)tetrahydropyran-2-yl]methyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [3,4,5,6-tetrakis(1-oxo-3-phenylpropoxy)-2-oxanyl]methyl ester IUPAC Name: [3,4,5,6-tetrakis(3-phenylpropanoyloxy)oxan-2-yl]methyl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid (3,4,5,6-tetrahydrocinnamoyloxytetrahydropyran-2-yl)methyl ester Formula: C51H52O11 MolecularWeight: 840.95198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)OCC2C(C(C(C(O2)OC(=O)CCC3=CC=CC=C3)OC(=O)CCC4=CC=CC=C4)OC(=O)CCC5=CC=CC=C5)OC(=O)CCC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)OCC2C(C(C(C(O2)OC(=O)CCC3=CC=CC=C3)OC(=O)CCC4=CC=CC=C4)OC(=O)CCC5=CC=CC=C5)OC(=O)CCC6=CC=CC=C6

InChI

InChI=1S/C51H52O11/c52-43(31-26-37-16-6-1-7-17-37)57-36-42-48(59-44(53)32-27-38-18-8-2-9-19-38)49(60-45(54)33-28-39-20-10-3-11-21-39)50(61-46(55)34-29-40-22-12-4-13-23-40)51(58-42)62-47(56)35-30-41-24-14-5-15-25-41/h1-25,42,48-51H,26-36H2