(2,3,5-triacetyloxy-5-cyano-pentyl) ethanoate

Systemtic Name: (2,3,5-triacetyloxy-5-cyano-pentyl) ethanoate Openeye Name: (2,3,5-triacetoxy-5-cyano-pentyl) acetate CAS Name: acetic acid (2,3,5-triacetyloxy-5-cyanopentyl) ester IUPAC Name: (2,3,5-triacetyloxy-5-cyanopentyl) acetate Traditional Name: acetic acid (2,3,5-triacetoxy-5-cyano-pentyl) ester Formula: C28H38N2O16 MolecularWeight: 658.60512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(CC(C#N)OC(=O)C)OC(=O)C)OC(=O)C.CC(=O)OCC(C(CC(C#N)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC(C(CC(C#N)OC(=O)C)OC(=O)C)OC(=O)C.CC(=O)OCC(C(CC(C#N)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/2C14H19NO8/c2*1-8(16)20-7-14(23-11(4)19)13(22-10(3)18)5-12(6-15)21-9(2)17/h2*12-14H,5,7H2,1-4H3